3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine

C14H28N2 — CID 115726743

IUPAC3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine
SMILESCCC(NC1CCCC(N(C)C)C1)C1CC1
InChIInChI=1S/C14H28N2/c1-4-14(11-8-9-11)15-12-6-5-7-13(10-12)16(2)3/h11-15H,4-10H2,1-3H3
InChIKeyGPYSEYUHRYPFJD-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds5

About 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine

3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine (PubChem CID 115726743) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine.

Molecular Properties

Compound Name3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine
PubChem CID115726743
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine
SMILESCCC(NC1CCCC(N(C)C)C1)C1CC1
InChIInChI=1S/C14H28N2/c1-4-14(11-8-9-11)15-12-6-5-7-13(10-12)16(2)3/h11-15H,4-10H2,1-3H3
InChIKeyGPYSEYUHRYPFJD-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-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

N-(1-cyclopropylpropyl)-3-(trifluoromethyl)cyclohexan-1-amine
CID 64917573
N-(1-cyclobutylpropyl)cyclopropanamine
CID 83682011
N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine
CID 64622957
3-N-(1-methoxybutan-2-yl)-1-N,1-N-dimethylcyclohexane-1,3-diamine
CID 115726742
trans-(1S,3S)-1-N,1-N,3-N-trimethylcyclohexane-1,3-diamine
CID 139514025
3-N-(1-methoxypropan-2-yl)-1-N,1-N-dimethylcyclohexane-1,3-diamine
CID 115726744
1-N-(1-cyclopropylethyl)-3-N,3-N-dimethylcyclopentane-1,3-diamine
CID 115897235
N-(1-cyclopropylpropyl)thiolan-3-amine
CID 103902644
trans-(1S,3S)-1-N,1-N,3-N,3-N-tetramethylcyclohexane-1,3-diamine
CID 101240385
4-N-(1-cyclohexylpropyl)cyclohexane-1,4-diamine
CID 79741042
1-N-hexan-2-yl-3-N,3-N-dimethylcyclopentane-1,3-diamine
CID 115897250
3-[(1-cyclopropyl-4-methylpentyl)amino]cyclohexan-1-ol
CID 114274449

Frequently Asked Questions

What is the IUPAC name of 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine?
The IUPAC name of 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine (CID 115726743) is 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine.
What is the SMILES notation for 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine?
The canonical SMILES for 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine is CCC(NC1CCCC(N(C)C)C1)C1CC1.
What is the InChIKey of 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine?
The InChIKey is GPYSEYUHRYPFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-14(11-8-9-11)15-12-6-5-7-13(10-12)16(2)3/h11-15H,4-10H2,1-3H3.
What are the key properties of 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine?
3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(1-cyclopropylpropyl)-1-N,1-N-dimethylcyclohexane-1,3-diamine is sourced from PubChem (CID 115726743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).