4-propan-2-ylcyclohexane-1,2-diamine

C9H20N2 — CID 22415223

IUPAC4-propan-2-ylcyclohexane-1,2-diamine
SMILESCC(C)C1CCC(N)C(N)C1
InChIInChI=1S/C9H20N2/c1-6(2)7-3-4-8(10)9(11)5-7/h6-9H,3-5,10-11H2,1-2H3
InChIKeyAYNJLCBPBQGVSC-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.10
Rot. Bonds1

About 4-propan-2-ylcyclohexane-1,2-diamine

4-propan-2-ylcyclohexane-1,2-diamine (PubChem CID 22415223) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 4-propan-2-ylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name4-propan-2-ylcyclohexane-1,2-diamine
PubChem CID22415223
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name4-propan-2-ylcyclohexane-1,2-diamine
SMILESCC(C)C1CCC(N)C(N)C1
InChIInChI=1S/C9H20N2/c1-6(2)7-3-4-8(10)9(11)5-7/h6-9H,3-5,10-11H2,1-2H3
InChIKeyAYNJLCBPBQGVSC-UHFFFAOYSA-N
XLogP1.10
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-propan-2-ylcyclohexane-1,2-diamine 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

2-(3-methylbutyl)-4-propan-2-ylcyclohexan-1-amine
CID 63401726
(3S)-3-propan-2-ylcyclopentan-1-amine
CID 140882360
2-(2-methylsulfonylethyl)-4-propan-2-ylcyclohexan-1-amine
CID 62739877
2-N-cycloheptyl-2-N-methyl-4-propan-2-ylcyclohexane-1,2-diamine
CID 63469021
2-[[cyclopropylmethyl(methyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62709059
2-(piperidin-1-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 55208973
4-propan-2-yl-2-(2-propoxyethyl)cyclohexan-1-amine
CID 106454508
2-N-methyl-2-N-(3-methylbutan-2-yl)-4-propan-2-ylcyclohexane-1,2-diamine
CID 55105769
propan-2-ylcyclopropane;hydroiodide
CID 162314014
4-propan-2-yl-2-[2-(trifluoromethylsulfanyl)ethyl]cyclohexan-1-amine
CID 116616692
2-(oxolan-2-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 62740576
2-(3-methylsulfonylpropyl)-4-propan-2-ylcyclohexan-1-amine
CID 63191907

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-ylcyclohexane-1,2-diamine?
The IUPAC name of 4-propan-2-ylcyclohexane-1,2-diamine (CID 22415223) is 4-propan-2-ylcyclohexane-1,2-diamine.
What is the SMILES notation for 4-propan-2-ylcyclohexane-1,2-diamine?
The canonical SMILES for 4-propan-2-ylcyclohexane-1,2-diamine is CC(C)C1CCC(N)C(N)C1.
What is the InChIKey of 4-propan-2-ylcyclohexane-1,2-diamine?
The InChIKey is AYNJLCBPBQGVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-6(2)7-3-4-8(10)9(11)5-7/h6-9H,3-5,10-11H2,1-2H3.
What are the key properties of 4-propan-2-ylcyclohexane-1,2-diamine?
4-propan-2-ylcyclohexane-1,2-diamine has a molecular weight of 156.27 g/mol, XLogP of 1.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-ylcyclohexane-1,2-diamine is sourced from PubChem (CID 22415223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).