2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine

C17H34N2 — CID 63465174

IUPAC2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine
SMILESCCNC1CCC(CC)CC1N1CCCCCCC1
InChIInChI=1S/C17H34N2/c1-3-15-10-11-16(18-4-2)17(14-15)19-12-8-6-5-7-9-13-19/h15-18H,3-14H2,1-2H3
InChIKeyPIBIVRXMFLDZOX-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.81
Rot. Bonds4

About 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine

2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine (PubChem CID 63465174) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine
PubChem CID63465174
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine
SMILESCCNC1CCC(CC)CC1N1CCCCCCC1
InChIInChI=1S/C17H34N2/c1-3-15-10-11-16(18-4-2)17(14-15)19-12-8-6-5-7-9-13-19/h15-18H,3-14H2,1-2H3
InChIKeyPIBIVRXMFLDZOX-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,4-diethyl-2-(4-propylpiperidin-1-yl)cyclohexan-1-amine
CID 63469848
N,4-diethyl-2-(2-ethylazepan-1-yl)cyclohexan-1-amine
CID 104689498
N,4-diethyl-2-(4-methylsulfonylpiperazin-1-yl)cyclohexan-1-amine
CID 62994122
N-ethyl-2-pyrrolidin-1-ylcyclododecan-1-amine
CID 63466183
N,4-diethyl-2-(3-methoxypyrrolidin-1-yl)cyclohexan-1-amine
CID 103532122
4-ethyl-2-(4-methylpiperidin-1-yl)-N-propylcyclohexan-1-amine
CID 55192276
(4-ethyl-2-piperidin-1-ylcyclohexyl)methanamine
CID 43293406
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-4-ethyl-N-propylcyclohexan-1-amine
CID 79928660
4-ethyl-N-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclohexan-1-amine
CID 63169906
4-ethyl-N-methyl-2-(1,4-oxazepan-4-yl)cyclohexan-1-amine
CID 62986422
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,4-diethylcyclohexan-1-amine
CID 63013027
2-(cyclohexylmethoxy)-N,4-diethylcyclohexan-1-amine
CID 63500914

Frequently Asked Questions

What is the IUPAC name of 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine?
The IUPAC name of 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine (CID 63465174) is 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine.
What is the SMILES notation for 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine?
The canonical SMILES for 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine is CCNC1CCC(CC)CC1N1CCCCCCC1.
What is the InChIKey of 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine?
The InChIKey is PIBIVRXMFLDZOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-3-15-10-11-16(18-4-2)17(14-15)19-12-8-6-5-7-9-13-19/h15-18H,3-14H2,1-2H3.
What are the key properties of 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine?
2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine is sourced from PubChem (CID 63465174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).