2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine

C12H15N5 — CID 80653271

IUPAC2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine
SMILESCCN(Cc1ccncc1)c1cnc(N)cn1
InChIInChI=1S/C12H15N5/c1-2-17(9-10-3-5-14-6-4-10)12-8-15-11(13)7-16-12/h3-8H,2,9H2,1H3,(H2,13,15)
InChIKeyPWCZSKYVWNBCBS-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.48
Rot. Bonds4

About 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine

2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine (PubChem CID 80653271) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine.

Molecular Properties

Compound Name2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine
PubChem CID80653271
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine
SMILESCCN(Cc1ccncc1)c1cnc(N)cn1
InChIInChI=1S/C12H15N5/c1-2-17(9-10-3-5-14-6-4-10)12-8-15-11(13)7-16-12/h3-8H,2,9H2,1H3,(H2,13,15)
InChIKeyPWCZSKYVWNBCBS-UHFFFAOYSA-N
XLogP1.48
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(aminomethyl)-N-ethyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 54948605
[6-[ethyl(pyridin-4-ylmethyl)amino]-3-pyridinyl]methanol
CID 54948162
2-N-ethyl-2-N-[(6-methyl-2-pyridinyl)methyl]pyrazine-2,5-diamine
CID 80652405
4-N,2-diethyl-4-N-(pyridin-4-ylmethyl)pyrimidine-4,6-diamine
CID 80933730
2-N-ethyl-3-methyl-2-N-(pyridin-4-ylmethyl)pyridine-2,5-diamine
CID 62476714
5-(aminomethyl)-N-ethyl-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine
CID 62750354
4-N-ethyl-4-N-(pyridin-4-ylmethyl)quinazoline-4,6-diamine
CID 64587906
2-N-ethyl-2-N-(pyridin-4-ylmethyl)benzene-1,2-diamine
CID 54948094
5-chloro-N-ethyl-4-(methylaminomethyl)-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 114925871
6-[(1R)-1-aminopropyl]-N-ethyl-N-(pyridin-4-ylmethyl)pyridin-3-amine
CID 103937134
2-[ethyl(pyridin-4-ylmethyl)amino]pyridine-4-carbothioamide
CID 61449400
2-N-(cyclobutylmethyl)-2-N-ethylpyrazine-2,5-diamine
CID 107402995

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine?
The IUPAC name of 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine (CID 80653271) is 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine.
What is the SMILES notation for 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine?
The canonical SMILES for 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine is CCN(Cc1ccncc1)c1cnc(N)cn1.
What is the InChIKey of 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine?
The InChIKey is PWCZSKYVWNBCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-2-17(9-10-3-5-14-6-4-10)12-8-15-11(13)7-16-12/h3-8H,2,9H2,1H3,(H2,13,15).
What are the key properties of 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine?
2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine has a molecular weight of 229.29 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-2-N-(pyridin-4-ylmethyl)pyrazine-2,5-diamine is sourced from PubChem (CID 80653271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).