4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine

C15H32N2 — CID 55073987

IUPAC4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine
SMILESCCCNCCCC(C)N(CC(C)C)C1CC1
InChIInChI=1S/C15H32N2/c1-5-10-16-11-6-7-14(4)17(12-13(2)3)15-8-9-15/h13-16H,5-12H2,1-4H3
InChIKeyJUKVKFSIGGGFGA-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.28
Rot. Bonds10

About 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine

4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine (PubChem CID 55073987) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine.

Molecular Properties

Compound Name4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine
PubChem CID55073987
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine
SMILESCCCNCCCC(C)N(CC(C)C)C1CC1
InChIInChI=1S/C15H32N2/c1-5-10-16-11-6-7-14(4)17(12-13(2)3)15-8-9-15/h13-16H,5-12H2,1-4H3
InChIKeyJUKVKFSIGGGFGA-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-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

Related Compounds

1-N,4-N-dicyclopropyl-4-N-(2-methylpropyl)pentane-1,4-diamine
CID 62429378
3-N-cyclopropyl-1-N-ethyl-3-N-(2-methylpropyl)butane-1,3-diamine
CID 62430260
4-N-cyclopropyl-4-N-(2-methylpropyl)pentane-1,4-diamine
CID 62430254
N-butyl-N'-cyclopropyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62555882
N'-methyl-N'-(2-methylpropyl)-N-propylpentane-1,5-diamine
CID 62421110
4-N-(cyclohexylmethyl)-4-N-methyl-1-N-propylpentane-1,4-diamine
CID 62412201
3-N-cyclopropyl-1-N-(2-methylpropyl)-3-N-propylbutane-1,3-diamine
CID 62420483
ethane;13-methyl-N-propyltetradecan-1-amine
CID 176934957
ethane;6-methyl-N-propylheptan-1-amine
CID 144802351
2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide
CID 83048058
2-N-cyclopropyl-2-N-ethyl-1-N-(3-methylbutyl)propane-1,2-diamine
CID 62570622
3-N,3-N-bis(2-methylpropyl)-1-N-propylbutane-1,3-diamine
CID 55073718

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine?
The IUPAC name of 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine (CID 55073987) is 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine.
What is the SMILES notation for 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine?
The canonical SMILES for 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine is CCCNCCCC(C)N(CC(C)C)C1CC1.
What is the InChIKey of 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine?
The InChIKey is JUKVKFSIGGGFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-5-10-16-11-6-7-14(4)17(12-13(2)3)15-8-9-15/h13-16H,5-12H2,1-4H3.
What are the key properties of 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine?
4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine has a molecular weight of 240.43 g/mol, XLogP of 3.28, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopropyl-4-N-(2-methylpropyl)-1-N-propylpentane-1,4-diamine is sourced from PubChem (CID 55073987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).