N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine

C14H30N2 — CID 65254511

IUPACN'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine
SMILESCCCN(CCCC(C)(C)CN)CC1CC1
InChIInChI=1S/C14H30N2/c1-4-9-16(11-13-6-7-13)10-5-8-14(2,3)12-15/h13H,4-12,15H2,1-3H3
InChIKeyOSGAHKLVHJEHJY-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.87
Rot. Bonds9

About N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine

N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine (PubChem CID 65254511) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine.

Molecular Properties

Compound NameN'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine
PubChem CID65254511
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine
SMILESCCCN(CCCC(C)(C)CN)CC1CC1
InChIInChI=1S/C14H30N2/c1-4-9-16(11-13-6-7-13)10-5-8-14(2,3)12-15/h13H,4-12,15H2,1-3H3
InChIKeyOSGAHKLVHJEHJY-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-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 N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine?
The IUPAC name of N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine (CID 65254511) is N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine.
What is the SMILES notation for N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine?
The canonical SMILES for N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine is CCCN(CCCC(C)(C)CN)CC1CC1.
What is the InChIKey of N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine?
The InChIKey is OSGAHKLVHJEHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-4-9-16(11-13-6-7-13)10-5-8-14(2,3)12-15/h13H,4-12,15H2,1-3H3.
What are the key properties of N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine?
N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine has a molecular weight of 226.41 g/mol, XLogP of 2.87, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine is sourced from PubChem (CID 65254511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).