4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine

C15H30N2 — CID 82934190

IUPAC4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine
SMILESCCCNC1CCC(NC2CCCCC2)CC1
InChIInChI=1S/C15H30N2/c1-2-12-16-13-8-10-15(11-9-13)17-14-6-4-3-5-7-14/h13-17H,2-12H2,1H3
InChIKeyVWGYIPVULLHRFW-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.22
Rot. Bonds5

About 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine

4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine (PubChem CID 82934190) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine.

Molecular Properties

Compound Name4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine
PubChem CID82934190
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine
SMILESCCCNC1CCC(NC2CCCCC2)CC1
InChIInChI=1S/C15H30N2/c1-2-12-16-13-8-10-15(11-9-13)17-14-6-4-3-5-7-14/h13-17H,2-12H2,1H3
InChIKeyVWGYIPVULLHRFW-UHFFFAOYSA-N
XLogP3.22
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine?
The IUPAC name of 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine (CID 82934190) is 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine.
What is the SMILES notation for 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine?
The canonical SMILES for 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine is CCCNC1CCC(NC2CCCCC2)CC1.
What is the InChIKey of 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine?
The InChIKey is VWGYIPVULLHRFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-2-12-16-13-8-10-15(11-9-13)17-14-6-4-3-5-7-14/h13-17H,2-12H2,1H3.
What are the key properties of 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine?
4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine has a molecular weight of 238.42 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclohexyl-1-N-propylcyclohexane-1,4-diamine is sourced from PubChem (CID 82934190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).