2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine

C18H36N2O — CID 106007566

IUPAC2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine
SMILESCC(C)OCCCCNC1CCCCC1C1CCCCN1
InChIInChI=1S/C18H36N2O/c1-15(2)21-14-8-7-13-20-17-10-4-3-9-16(17)18-11-5-6-12-19-18/h15-20H,3-14H2,1-2H3
InChIKeyCOZITRZSTFVSEX-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.48
Rot. Bonds8

About 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine

2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine (PubChem CID 106007566) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine
PubChem CID106007566
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine
SMILESCC(C)OCCCCNC1CCCCC1C1CCCCN1
InChIInChI=1S/C18H36N2O/c1-15(2)21-14-8-7-13-20-17-10-4-3-9-16(17)18-11-5-6-12-19-18/h15-20H,3-14H2,1-2H3
InChIKeyCOZITRZSTFVSEX-UHFFFAOYSA-N
XLogP3.48
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-piperidin-2-yl-N-(3-propan-2-yloxypropyl)cyclohexan-1-amine
CID 79552730
N-(2-propan-2-yloxyethyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 104759328
N-hexyl-2-piperidin-2-ylcyclopentan-1-amine
CID 79545809
N-[3-(2-methoxyethoxy)propyl]-2-piperidin-2-ylcyclohexan-1-amine
CID 79541663
5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol
CID 106122125
N'-methyl-N-(2-piperidin-2-ylcyclohexyl)-N'-propan-2-ylethane-1,2-diamine
CID 79553044
3-[(2-piperidin-2-ylcyclopentyl)amino]propan-1-ol
CID 79544914
N-(2-methylpropyl)-2-piperidin-2-ylcyclopentan-1-amine
CID 79544832
N',N'-diethyl-N-(2-piperidin-2-ylcyclohexyl)propane-1,3-diamine
CID 79537332
N-[3-(cyclopropylmethoxy)propyl]-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 79546596
2-propan-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine
CID 113383965
N-(3-methylsulfanylpropyl)-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 79549363

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine?
The IUPAC name of 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine (CID 106007566) is 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine.
What is the SMILES notation for 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine?
The canonical SMILES for 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine is CC(C)OCCCCNC1CCCCC1C1CCCCN1.
What is the InChIKey of 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine?
The InChIKey is COZITRZSTFVSEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-15(2)21-14-8-7-13-20-17-10-4-3-9-16(17)18-11-5-6-12-19-18/h15-20H,3-14H2,1-2H3.
What are the key properties of 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine?
2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine has a molecular weight of 296.50 g/mol, XLogP of 3.48, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine is sourced from PubChem (CID 106007566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).