4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine

C117H242N12O13 — CID 158451516

IUPAC4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine
SMILESCC(C)OCCCN1CC2(CCC2)C1.CC(C)OCCCN1CCC(C(C)(C)C)CC1.CC(C)OCCCN1CCN(C)CC1.CC(C)OCCN1CC(C)OC(C)C1.CC(C)OCCN1CC2(CCC2)C1.CC(C)OCCN1CCC(C(C)(C)O)CC1.CC(C)OCCN1CCCCC1.CC(C)OCCN1CCN(C(C)C)CC1.CC(C)OCCN1C[C@@H](C)O[C@@H](C)C1.CC1CCN(CCOC(C)C)CC1
InChIInChI=1S/C15H31NO.C13H27NO2.C12H26N2O.C12H23NO.C11H24N2O.2C11H23NO2.C11H21NO.C11H23NO.C10H21NO/c1-13(2)17-12-6-9-16-10-7-14(8-11-16)15(3,4)5;1-11(2)16-10-9-14-7-5-12(6-8-14)13(3,4)15;1-11(2)14-7-5-13(6-8-14)9-10-15-12(3)4;1-11(2)14-8-4-7-13-9-12(10-13)5-3-6-12;1-11(2)14-10-4-5-13-8-6-12(3)7-9-13;2*1-9(2)13-6-5-12-7-10(3)14-11(4)8-12;1-10(2)13-7-6-12-8-11(9-12)4-3-5-11;1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-10(2)12-9-8-11-6-4-3-5-7-11/h13-14H,6-12H2,1-5H3;11-12,15H,5-10H2,1-4H3;11-12H,5-10H2,1-4H3;11H,3-10H2,1-2H3;11H,4-10H2,1-3H3;2*9-11H,5-8H2,1-4H3;10H,3-9H2,1-2H3;10-11H,4-9H2,1-3H3;10H,3-9H2,1-2H3/t;;;;;10-,11+;;;;
InChIKeyHEBARQWRUHIHHS-BODSPJTGSA-N
MW2025.29 g/mol
LogP19.21
Rot. Bonds45

About 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine

4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine (PubChem CID 158451516) has the molecular formula C117H242N12O13 and a molecular weight of 2025.29 g/mol. Its IUPAC name is 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine.

Molecular Properties

Compound Name4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine
PubChem CID158451516
Molecular FormulaC117H242N12O13
Molecular Weight2025.29 g/mol
Exact Mass2023.86
IUPAC Name4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine
SMILESCC(C)OCCCN1CC2(CCC2)C1.CC(C)OCCCN1CCC(C(C)(C)C)CC1.CC(C)OCCCN1CCN(C)CC1.CC(C)OCCN1CC(C)OC(C)C1.CC(C)OCCN1CC2(CCC2)C1.CC(C)OCCN1CCC(C(C)(C)O)CC1.CC(C)OCCN1CCCCC1.CC(C)OCCN1CCN(C(C)C)CC1.CC(C)OCCN1C[C@@H](C)O[C@@H](C)C1.CC1CCN(CCOC(C)C)CC1
InChIInChI=1S/C15H31NO.C13H27NO2.C12H26N2O.C12H23NO.C11H24N2O.2C11H23NO2.C11H21NO.C11H23NO.C10H21NO/c1-13(2)17-12-6-9-16-10-7-14(8-11-16)15(3,4)5;1-11(2)16-10-9-14-7-5-12(6-8-14)13(3,4)15;1-11(2)14-7-5-13(6-8-14)9-10-15-12(3)4;1-11(2)14-8-4-7-13-9-12(10-13)5-3-6-12;1-11(2)14-10-4-5-13-8-6-12(3)7-9-13;2*1-9(2)13-6-5-12-7-10(3)14-11(4)8-12;1-10(2)13-7-6-12-8-11(9-12)4-3-5-11;1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-10(2)12-9-8-11-6-4-3-5-7-11/h13-14H,6-12H2,1-5H3;11-12,15H,5-10H2,1-4H3;11-12H,5-10H2,1-4H3;11H,3-10H2,1-2H3;11H,4-10H2,1-3H3;2*9-11H,5-8H2,1-4H3;10H,3-9H2,1-2H3;10-11H,4-9H2,1-3H3;10H,3-9H2,1-2H3/t;;;;;10-,11+;;;;
InChIKeyHEBARQWRUHIHHS-BODSPJTGSA-N
XLogP19.21
TPSA169.87 Ų
H-Bond Donors1
H-Bond Acceptors25
Rotatable Bonds45
Heavy Atoms142
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002025.29
LogP ≤ 519.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine with MolForge

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Launch Full Analysis

Related Compounds

(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;(2R,6S)-2,6-dimethyl-4-(3-propan-2-yloxypropyl)morpholine;2,6-dimethyl-4-(3-propan-2-yloxypropyl)morpholine;2,2-dimethyl-1-(3-propan-2-yloxypropyl)piperidine;3,3-dimethyl-1-(3-propan-2-yloxypropyl)piperidine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine
CID 159323633
(2S,6R)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;methane;4-methyl-1-(3-propan-2-yloxypropyl)piperidine;propan-2-yl 4-morpholin-4-ylbutanoate;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;(2S)-3-propan-2-yloxypropane-1,2-diol;(2R)-3-propan-2-yloxypropane-1,2-diol;3-propan-2-yloxypropane-1,2-diol;2-[1-(3-propan-2-yloxypropyl)piperidin-4-yl]propan-2-ol;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine;propan-2-yl 4-(1,2,4-triazol-1-yl)butanoate
CID 167553062
ethane;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol
CID 156869049
2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane
CID 138616757
2,6-dimethyl-4-(3-propan-2-yloxypropyl)morpholine
CID 154661277
2-methylpropane;(2R)-2-methyl-4-(3-propan-2-yloxypropyl)morpholine;(2S)-2-methyl-4-(3-propan-2-yloxypropyl)morpholine;(3S)-3-methyl-4-(3-propan-2-yloxypropyl)morpholine;(3R)-3-methyl-4-(3-propan-2-yloxypropyl)morpholine;3-methyl-4-(3-propan-2-yloxypropyl)morpholine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;1-propan-2-yloxybutane;1-propan-2-yloxypropane;4-(3-propan-2-yloxypropyl)morpholine;1-(3-propan-2-yloxypropyl)piperidine;1-propan-2-yl-4-(3-propan-2-yloxypropyl)piperazine
CID 167630181
(5S)-2,9-bis(2-propan-2-yloxyethyl)-2,9-diazaspiro[4.5]decane
CID 176678662
1-methyl-4-[3-(3-propan-2-yloxypropoxy)propyl]piperazine
CID 135178116
1,4-dimethylpiperidine;methane;1-methylpiperidine;2,4,6-trimethylmorpholine
CID 158607105
1-methyl-4-[2-[3-[1-(2-propan-2-yloxyethyl)piperidin-3-yl]propoxy]ethyl]piperazine
CID 153398953
2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine
CID 102936700
N-[2-(4-methylpiperidin-1-yl)ethyl]-3-propan-2-yloxypropan-1-amine
CID 62575890

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine?
The IUPAC name of 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine (CID 158451516) is 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine.
What is the SMILES notation for 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine?
The canonical SMILES for 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine is CC(C)OCCCN1CC2(CCC2)C1.CC(C)OCCCN1CCC(C(C)(C)C)CC1.CC(C)OCCCN1CCN(C)CC1.CC(C)OCCN1CC(C)OC(C)C1.CC(C)OCCN1CC2(CCC2)C1.CC(C)OCCN1CCC(C(C)(C)O)CC1.CC(C)OCCN1CCCCC1.CC(C)OCCN1CCN(C(C)C)CC1.CC(C)OCCN1C[C@@H](C)O[C@@H](C)C1.CC1CCN(CCOC(C)C)CC1.
What is the InChIKey of 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine?
The InChIKey is HEBARQWRUHIHHS-BODSPJTGSA-N. The full InChI is InChI=1S/C15H31NO.C13H27NO2.C12H26N2O.C12H23NO.C11H24N2O.2C11H23NO2.C11H21NO.C11H23NO.C10H21NO/c1-13(2)17-12-6-9-16-10-7-14(8-11-16)15(3,4)5;1-11(2)16-10-9-14-7-5-12(6-8-14)13(3,4)15;1-11(2)14-7-5-13(6-8-14)9-10-15-12(3)4;1-11(2)14-8-4-7-13-9-12(10-13)5-3-6-12;1-11(2)14-10-4-5-13-8-6-12(3)7-9-13;2*1-9(2)13-6-5-12-7-10(3)14-11(4)8-12;1-10(2)13-7-6-12-8-11(9-12)4-3-5-11;1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-10(2)12-9-8-11-6-4-3-5-7-11/h13-14H,6-12H2,1-5H3;11-12,15H,5-10H2,1-4H3;11-12H,5-10H2,1-4H3;11H,3-10H2,1-2H3;11H,4-10H2,1-3H3;2*9-11H,5-8H2,1-4H3;10H,3-9H2,1-2H3;10-11H,4-9H2,1-3H3;10H,3-9H2,1-2H3/t;;;;;10-,11+;;;;.
What are the key properties of 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine?
4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine has a molecular weight of 2025.29 g/mol, XLogP of 19.21, 45 rotatable bonds, 1 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-1-(3-propan-2-yloxypropyl)piperidine;(2R,6S)-2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;2,6-dimethyl-4-(2-propan-2-yloxyethyl)morpholine;4-methyl-1-(2-propan-2-yloxyethyl)piperidine;1-methyl-4-(3-propan-2-yloxypropyl)piperazine;2-(2-propan-2-yloxyethyl)-2-azaspiro[3.3]heptane;1-(2-propan-2-yloxyethyl)piperidine;2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propan-2-ol;2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane;1-propan-2-yl-4-(2-propan-2-yloxyethyl)piperazine is sourced from PubChem (CID 158451516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).