3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine

C15H19N3 — CID 81246098

IUPAC3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine
SMILESCc1cccc(CN(C)c2ccncc2CN)c1
InChIInChI=1S/C15H19N3/c1-12-4-3-5-13(8-12)11-18(2)15-6-7-17-10-14(15)9-16/h3-8,10H,9,11,16H2,1-2H3
InChIKeyHSAYRRWGKTXTTR-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.49
Rot. Bonds4

About 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine

3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine (PubChem CID 81246098) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine
PubChem CID81246098
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine
SMILESCc1cccc(CN(C)c2ccncc2CN)c1
InChIInChI=1S/C15H19N3/c1-12-4-3-5-13(8-12)11-18(2)15-6-7-17-10-14(15)9-16/h3-8,10H,9,11,16H2,1-2H3
InChIKeyHSAYRRWGKTXTTR-UHFFFAOYSA-N
XLogP2.49
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine
CID 81246986
N-methyl-N-[(3-methylphenyl)methyl]-3-(propylaminomethyl)pyridin-4-amine
CID 81253106
3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
CID 81246480
6-N-methyl-6-N-[(3-methylphenyl)methyl]isoquinoline-5,6-diamine
CID 106947745
3-(aminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyridin-4-amine
CID 81246090
2-(aminomethyl)-N,6-dimethyl-N-[(3-methylphenyl)methyl]aniline
CID 107105568
N-[(3-chlorophenyl)methyl]-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81246803
2-(aminomethyl)-3-bromo-N-methyl-N-[(3-methylphenyl)methyl]aniline
CID 114879522
4-N-methyl-4-N-[(3-methylphenyl)methyl]-1H-pyrazole-4,5-diamine
CID 82236914
4-(aminomethyl)-2-bromo-N-methyl-N-[(3-methylphenyl)methyl]aniline
CID 82793405
3-(aminomethyl)-N-(2,2-dimethylpropyl)-N-methylpyridin-4-amine
CID 81246543
N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline
CID 61411671

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine?
The IUPAC name of 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine (CID 81246098) is 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine?
The canonical SMILES for 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine is Cc1cccc(CN(C)c2ccncc2CN)c1.
What is the InChIKey of 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine?
The InChIKey is HSAYRRWGKTXTTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-12-4-3-5-13(8-12)11-18(2)15-6-7-17-10-14(15)9-16/h3-8,10H,9,11,16H2,1-2H3.
What are the key properties of 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine?
3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine is sourced from PubChem (CID 81246098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).