4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine

C17H34N2 — CID 114763370

IUPAC4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(N2CCCC(CC)CC2)CC1
InChIInChI=1S/C17H34N2/c1-3-12-18-16-7-9-17(10-8-16)19-13-5-6-15(4-2)11-14-19/h15-18H,3-14H2,1-2H3
InChIKeyDFIJDTLYZWXTJU-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.81
Rot. Bonds5

About 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine

4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine (PubChem CID 114763370) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine
PubChem CID114763370
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(N2CCCC(CC)CC2)CC1
InChIInChI=1S/C17H34N2/c1-3-12-18-16-7-9-17(10-8-16)19-13-5-6-15(4-2)11-14-19/h15-18H,3-14H2,1-2H3
InChIKeyDFIJDTLYZWXTJU-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-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

(4S)-N-[4-(4-methylpiperidin-1-yl)cyclohexyl]azepan-4-amine
CID 171359336
1-N,4-N-bis(2-ethylhexyl)cyclohexane-1,4-diamine
CID 11099841
2,8-dimethyl-N-[3-(4-methylazepan-1-yl)propyl]nonan-5-amine
CID 19026115
N-[7-(azepan-1-yl)heptyl]-2,8-dimethylnonan-5-amine
CID 19026120
N-(azepan-4-ylmethyl)-N-methylpropan-2-amine
CID 21024108
N-(azepan-4-ylmethyl)propan-2-amine
CID 21024109
N-[[4-[(butan-2-ylamino)methyl]cyclohexyl]methyl]butan-2-amine
CID 21071848
4-N-(cyclopentylmethyl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 57650660
4-N-tert-butyl-1-N-(2-ethylbutyl)cyclohexane-1,4-diamine
CID 58707411
cis-(1R,2S)-2-(azepan-1-ylmethyl)-N-methylcyclohexan-1-amine
CID 59007472
4-(Azepan-1-ylmethyl)cyclohexan-1-amine
CID 60851225
4-Methyl-1-piperidin-4-ylazepane
CID 63624273

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine?
The IUPAC name of 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine (CID 114763370) is 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine.
What is the SMILES notation for 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine?
The canonical SMILES for 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine is CCCNC1CCC(N2CCCC(CC)CC2)CC1.
What is the InChIKey of 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine?
The InChIKey is DFIJDTLYZWXTJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-3-12-18-16-7-9-17(10-8-16)19-13-5-6-15(4-2)11-14-19/h15-18H,3-14H2,1-2H3.
What are the key properties of 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine?
4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine is sourced from PubChem (CID 114763370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).