N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine

C14H25N3 — CID 65233301

IUPACN'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
SMILESCCCC(CN)CN(CC)Cc1ccncc1
InChIInChI=1S/C14H25N3/c1-3-5-14(10-15)12-17(4-2)11-13-6-8-16-9-7-13/h6-9,14H,3-5,10-12,15H2,1-2H3
InChIKeyXLSUUEKZVYJHRL-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.28
Rot. Bonds8

About N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine

N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine (PubChem CID 65233301) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
PubChem CID65233301
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC NameN'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
SMILESCCCC(CN)CN(CC)Cc1ccncc1
InChIInChI=1S/C14H25N3/c1-3-5-14(10-15)12-17(4-2)11-13-6-8-16-9-7-13/h6-9,14H,3-5,10-12,15H2,1-2H3
InChIKeyXLSUUEKZVYJHRL-UHFFFAOYSA-N
XLogP2.28
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-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'-ethyl-2-methoxy-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
CID 106114657
1-N-ethyl-1-N-(pyridin-4-ylmethyl)hexane-1,2-diamine
CID 54948170
2-ethoxy-N'-ethyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
CID 55146279
1-N-ethyl-3,3-dimethyl-1-N-(pyridin-4-ylmethyl)butane-1,2-diamine
CID 54948462
N-[[4-(aminomethyl)phenyl]methyl]-2-ethyl-N-(pyridin-4-ylmethyl)butan-1-amine
CID 23992654
1-N-ethyl-4-methyl-1-N-(pyridin-4-ylmethyl)pentane-1,2-diamine
CID 54948017
1-chloro-3-[ethyl(pyridin-4-ylmethyl)amino]propan-2-ol
CID 112561407
N-ethyl-2-methyl-N'-propyl-N-(pyridin-4-ylmethyl)propane-1,3-diamine
CID 62429709
N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine
CID 78896115
1-N,2-N-diethyl-1-N-(pyridin-4-ylmethyl)butane-1,2-diamine
CID 62038864
3-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropanehydrazide
CID 55213852
1-cyclopropyl-N-ethyl-N-(pyridin-4-ylmethyl)ethane-1,2-diamine
CID 61450542

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine?
The IUPAC name of N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine (CID 65233301) is N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine.
What is the SMILES notation for N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine?
The canonical SMILES for N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine is CCCC(CN)CN(CC)Cc1ccncc1.
What is the InChIKey of N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine?
The InChIKey is XLSUUEKZVYJHRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-3-5-14(10-15)12-17(4-2)11-13-6-8-16-9-7-13/h6-9,14H,3-5,10-12,15H2,1-2H3.
What are the key properties of N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine?
N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine has a molecular weight of 235.38 g/mol, XLogP of 2.28, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine is sourced from PubChem (CID 65233301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).