1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine

C14H25N3 — CID 81490426

IUPAC1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine
SMILESCC(C)C(N)CCN(C)CCc1cccnc1
InChIInChI=1S/C14H25N3/c1-12(2)14(15)7-10-17(3)9-6-13-5-4-8-16-11-13/h4-5,8,11-12,14H,6-7,9-10,15H2,1-3H3
InChIKeySCZLPEQXBLBAHQ-UHFFFAOYSA-N
MW235.38 g/mol
LogP1.93
Rot. Bonds7

About 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine

1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine (PubChem CID 81490426) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine.

Molecular Properties

Compound Name1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine
PubChem CID81490426
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine
SMILESCC(C)C(N)CCN(C)CCc1cccnc1
InChIInChI=1S/C14H25N3/c1-12(2)14(15)7-10-17(3)9-6-13-5-4-8-16-11-13/h4-5,8,11-12,14H,6-7,9-10,15H2,1-3H3
InChIKeySCZLPEQXBLBAHQ-UHFFFAOYSA-N
XLogP1.93
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-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

2-N-methyl-2-N-(2-pyridin-3-ylethyl)propane-1,2-diamine
CID 112708855
2-ethyl-N'-methyl-N'-(2-pyridin-3-ylethyl)propane-1,3-diamine
CID 115251756
3-methyl-4-[methyl(2-pyridin-3-ylethyl)amino]butanoic acid
CID 115220133
1-N-methyl-1-N-(2-phenylethyl)butane-1,3-diamine
CID 65488739
6-methyl-1-pyridin-3-ylheptan-3-amine
CID 105127244
2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile
CID 63264562
1-N,1-N-dimethyl-4-pyridin-3-ylbutane-1,3-diamine
CID 104736690
methyl(2-pyridin-3-ylethyl)cyanamide
CID 117043571
1-pyridin-3-ylhexan-3-amine
CID 64506028
N,5-dimethyl-N-(pyridin-3-ylmethyl)hexan-1-amine
CID 59176505
3-(5-methylhexyl)pyridine
CID 54316004
4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol
CID 115239951

Frequently Asked Questions

What is the IUPAC name of 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine?
The IUPAC name of 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine (CID 81490426) is 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine.
What is the SMILES notation for 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine?
The canonical SMILES for 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine is CC(C)C(N)CCN(C)CCc1cccnc1.
What is the InChIKey of 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine?
The InChIKey is SCZLPEQXBLBAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-12(2)14(15)7-10-17(3)9-6-13-5-4-8-16-11-13/h4-5,8,11-12,14H,6-7,9-10,15H2,1-3H3.
What are the key properties of 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine?
1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine has a molecular weight of 235.38 g/mol, XLogP of 1.93, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine is sourced from PubChem (CID 81490426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).