3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine

C15H19N3 — CID 81248963

IUPAC3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine
SMILESCCN(Cc1ccccc1)c1ccncc1CN
InChIInChI=1S/C15H19N3/c1-2-18(12-13-6-4-3-5-7-13)15-8-9-17-11-14(15)10-16/h3-9,11H,2,10,12,16H2,1H3
InChIKeyIUDSGASWHUOCKW-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.57
Rot. Bonds5

About 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine

3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine (PubChem CID 81248963) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine
PubChem CID81248963
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine
SMILESCCN(Cc1ccccc1)c1ccncc1CN
InChIInChI=1S/C15H19N3/c1-2-18(12-13-6-4-3-5-7-13)15-8-9-17-11-14(15)10-16/h3-9,11H,2,10,12,16H2,1H3
InChIKeyIUDSGASWHUOCKW-UHFFFAOYSA-N
XLogP2.57
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[benzyl(ethyl)amino]-4-pyridinyl]methanol
CID 105066690
3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine
CID 81247312
3-(aminomethyl)-N-ethyl-N-(2-methylphenyl)pyridin-4-amine
CID 81249174
2-N-ethyl-2-N-(pyridin-4-ylmethyl)benzene-1,2-diamine
CID 54948094
3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine
CID 82952880
3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
CID 81246480
3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine
CID 81246098
3-(aminomethyl)-N-benzyl-N-ethylpyrazin-2-amine
CID 62672158
3-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
CID 81248637
N-ethyl-2-(ethylaminomethyl)-N-(pyridin-4-ylmethyl)aniline
CID 61448906
4-N-ethyl-4-N-[(2-methylphenyl)methyl]pyridine-3,4-diamine
CID 43587748
[4-[benzyl(propan-2-yl)amino]-3-pyridinyl]methanol
CID 81237660

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine?
The IUPAC name of 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine (CID 81248963) is 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine.
What is the SMILES notation for 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine?
The canonical SMILES for 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine is CCN(Cc1ccccc1)c1ccncc1CN.
What is the InChIKey of 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine?
The InChIKey is IUDSGASWHUOCKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-2-18(12-13-6-4-3-5-7-13)15-8-9-17-11-14(15)10-16/h3-9,11H,2,10,12,16H2,1H3.
What are the key properties of 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine?
3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine is sourced from PubChem (CID 81248963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).