1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine

C13H28N2 — CID 62043365

IUPAC1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine
SMILESCCCNC(CCC)CN(C)CC1CC1
InChIInChI=1S/C13H28N2/c1-4-6-13(14-9-5-2)11-15(3)10-12-7-8-12/h12-14H,4-11H2,1-3H3
InChIKeyRPENXHLUWBQGHA-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.50
Rot. Bonds9

About 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine

1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine (PubChem CID 62043365) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine.

Molecular Properties

Compound Name1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine
PubChem CID62043365
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine
SMILESCCCNC(CCC)CN(C)CC1CC1
InChIInChI=1S/C13H28N2/c1-4-6-13(14-9-5-2)11-15(3)10-12-7-8-12/h12-14H,4-11H2,1-3H3
InChIKeyRPENXHLUWBQGHA-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-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

1-cyclopropyl-N'-(cyclopropylmethyl)-N'-methyl-N-propylethane-1,2-diamine
CID 63913660
1-N-(cyclopentylmethyl)-1-N,2-N-dimethylpentane-1,2-diamine
CID 63631754
3-methoxy-1-N-methyl-1-N-(oxan-4-ylmethyl)-2-N-propylpropane-1,2-diamine
CID 107505775
4-[cyclobutylmethyl(methyl)amino]-2-(propylamino)butan-1-ol
CID 64787236
4-[cyclohexylmethyl(methyl)amino]-2-(propylamino)butan-1-ol
CID 64827016
N'-(cyclopropylmethyl)-N'-methyl-N-pentan-2-ylethane-1,2-diamine
CID 62561272
N'-(cyclopropylmethyl)-N'-methyl-N-propyl-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 63468848
3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]-2-(propylamino)propanenitrile
CID 55174034
4-[cyclohexylmethyl(methyl)amino]-3-(ethylamino)butan-1-ol
CID 64897747
1-cyclohexyl-N-propylpentan-2-amine
CID 63413972
3-[cyclobutylmethyl(methyl)amino]-2-(propylamino)propanoic acid
CID 62861378
1-N-(cyclopentylmethyl)-1-N-methyl-3-N-propylbutane-1,3-diamine
CID 63632628

Frequently Asked Questions

What is the IUPAC name of 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine?
The IUPAC name of 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine (CID 62043365) is 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine.
What is the SMILES notation for 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine?
The canonical SMILES for 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine is CCCNC(CCC)CN(C)CC1CC1.
What is the InChIKey of 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine?
The InChIKey is RPENXHLUWBQGHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-4-6-13(14-9-5-2)11-15(3)10-12-7-8-12/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine?
1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine has a molecular weight of 212.38 g/mol, XLogP of 2.50, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(cyclopropylmethyl)-1-N-methyl-2-N-propylpentane-1,2-diamine is sourced from PubChem (CID 62043365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).