N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane

C132H281N21O8 — CID 159441683

IUPACN,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane
SMILESC1CNCOC1.CC(C)C(=O)NC1CCN(C)CC1.CC(C)CC1CN(C)C1.CC(C)N(C)C1CCCCC1.CC(C)N(C)C1CCN(C)CC1.CC(C)N1CCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)NC(=O)C1CCN(C)CC1.CC(C)OC1CCN(C)CC1.CC(C)OC1CCOCC1.CC(C)OCCN1CCN(C)CC1.CCC1CCCN(C)C1.CCC1CCCOC1.CCC1CNC1.CCN1CCN(C(C)C)CC1
InChIInChI=1S/C10H22N2O.2C10H20N2O.2C10H22N2.C10H21N.C9H20N2.C9H19NO.C8H18N2.2C8H17N.C8H16O2.C7H14O.C6H13N.C5H11N.C4H9NO/c1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-8(2)11-10(13)9-4-6-12(3)7-5-9;1-8(2)10(13)11-9-4-6-12(3)7-5-9;1-9(2)12(4)10-5-7-11(3)8-6-10;1-9(2)11-5-7-12(8-6-11)10(3)4;1-9(2)11(3)10-7-5-4-6-8-10;1-4-10-5-7-11(8-6-10)9(2)3;1-8(2)11-9-4-6-10(3)7-5-9;1-8(2)10-6-4-9(3)5-7-10;1-7(2)4-8-5-9(3)6-8;1-3-8-5-4-6-9(2)7-8;1-7(2)10-8-3-5-9-6-4-8;1-2-7-4-3-5-8-6-7;1-6(2)7-4-3-5-7;1-2-5-3-6-4-5;1-2-5-4-6-3-1/h10H,4-9H2,1-3H3;2*8-9H,4-7H2,1-3H3,(H,11,13);2*9-10H,5-8H2,1-4H3;9-10H,4-8H2,1-3H3;9H,4-8H2,1-3H3;8-9H,4-7H2,1-3H3;8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;7H,2-6H2,1H3;6H,3-5H2,1-2H3;5-6H,2-4H2,1H3;5H,1-4H2
InChIKeyLSGFMSSGTMACNB-UHFFFAOYSA-N
MW2290.84 g/mol
LogP19.46
Rot. Bonds27

About N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane

N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane (PubChem CID 159441683) has the molecular formula C132H281N21O8 and a molecular weight of 2290.84 g/mol. Its IUPAC name is N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane.

Molecular Properties

Compound NameN,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane
PubChem CID159441683
Molecular FormulaC132H281N21O8
Molecular Weight2290.84 g/mol
Exact Mass2289.22
IUPAC NameN,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane
SMILESC1CNCOC1.CC(C)C(=O)NC1CCN(C)CC1.CC(C)CC1CN(C)C1.CC(C)N(C)C1CCCCC1.CC(C)N(C)C1CCN(C)CC1.CC(C)N1CCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)NC(=O)C1CCN(C)CC1.CC(C)OC1CCN(C)CC1.CC(C)OC1CCOCC1.CC(C)OCCN1CCN(C)CC1.CCC1CCCN(C)C1.CCC1CCCOC1.CCC1CNC1.CCN1CCN(C(C)C)CC1
InChIInChI=1S/C10H22N2O.2C10H20N2O.2C10H22N2.C10H21N.C9H20N2.C9H19NO.C8H18N2.2C8H17N.C8H16O2.C7H14O.C6H13N.C5H11N.C4H9NO/c1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-8(2)11-10(13)9-4-6-12(3)7-5-9;1-8(2)10(13)11-9-4-6-12(3)7-5-9;1-9(2)12(4)10-5-7-11(3)8-6-10;1-9(2)11-5-7-12(8-6-11)10(3)4;1-9(2)11(3)10-7-5-4-6-8-10;1-4-10-5-7-11(8-6-10)9(2)3;1-8(2)11-9-4-6-10(3)7-5-9;1-8(2)10-6-4-9(3)5-7-10;1-7(2)4-8-5-9(3)6-8;1-3-8-5-4-6-9(2)7-8;1-7(2)10-8-3-5-9-6-4-8;1-2-7-4-3-5-8-6-7;1-6(2)7-4-3-5-7;1-2-5-3-6-4-5;1-2-5-4-6-3-1/h10H,4-9H2,1-3H3;2*8-9H,4-7H2,1-3H3,(H,11,13);2*9-10H,5-8H2,1-4H3;9-10H,4-8H2,1-3H3;9H,4-8H2,1-3H3;8-9H,4-7H2,1-3H3;8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;7H,2-6H2,1H3;6H,3-5H2,1-2H3;5-6H,2-4H2,1H3;5H,1-4H2
InChIKeyLSGFMSSGTMACNB-UHFFFAOYSA-N
XLogP19.46
TPSA192.72 Ų
H-Bond Donors4
H-Bond Acceptors27
Rotatable Bonds27
Heavy Atoms161
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002290.84
LogP ≤ 519.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1027

Analyze N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane?
The IUPAC name of N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane (CID 159441683) is N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane.
What is the SMILES notation for N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane?
The canonical SMILES for N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane is C1CNCOC1.CC(C)C(=O)NC1CCN(C)CC1.CC(C)CC1CN(C)C1.CC(C)N(C)C1CCCCC1.CC(C)N(C)C1CCN(C)CC1.CC(C)N1CCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)NC(=O)C1CCN(C)CC1.CC(C)OC1CCN(C)CC1.CC(C)OC1CCOCC1.CC(C)OCCN1CCN(C)CC1.CCC1CCCN(C)C1.CCC1CCCOC1.CCC1CNC1.CCN1CCN(C(C)C)CC1.
What is the InChIKey of N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane?
The InChIKey is LSGFMSSGTMACNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O.2C10H20N2O.2C10H22N2.C10H21N.C9H20N2.C9H19NO.C8H18N2.2C8H17N.C8H16O2.C7H14O.C6H13N.C5H11N.C4H9NO/c1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-8(2)11-10(13)9-4-6-12(3)7-5-9;1-8(2)10(13)11-9-4-6-12(3)7-5-9;1-9(2)12(4)10-5-7-11(3)8-6-10;1-9(2)11-5-7-12(8-6-11)10(3)4;1-9(2)11(3)10-7-5-4-6-8-10;1-4-10-5-7-11(8-6-10)9(2)3;1-8(2)11-9-4-6-10(3)7-5-9;1-8(2)10-6-4-9(3)5-7-10;1-7(2)4-8-5-9(3)6-8;1-3-8-5-4-6-9(2)7-8;1-7(2)10-8-3-5-9-6-4-8;1-2-7-4-3-5-8-6-7;1-6(2)7-4-3-5-7;1-2-5-3-6-4-5;1-2-5-4-6-3-1/h10H,4-9H2,1-3H3;2*8-9H,4-7H2,1-3H3,(H,11,13);2*9-10H,5-8H2,1-4H3;9-10H,4-8H2,1-3H3;9H,4-8H2,1-3H3;8-9H,4-7H2,1-3H3;8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;7H,2-6H2,1H3;6H,3-5H2,1-2H3;5-6H,2-4H2,1H3;5H,1-4H2.
What are the key properties of N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane?
N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane has a molecular weight of 2290.84 g/mol, XLogP of 19.46, 27 rotatable bonds, 4 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;3-ethylazetidine;3-ethyl-1-methylpiperidine;3-ethyloxane;1-ethyl-4-propan-2-ylpiperazine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-3-(2-methylpropyl)azetidine;N-methyl-N-propan-2-ylcyclohexanamine;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidine-4-carboxamide;1,3-oxazinane;1-propan-2-ylazetidine;4-propan-2-yloxyoxane is sourced from PubChem (CID 159441683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).