N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine

C15H18N2 — CID 79041859

IUPACN-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine
SMILESCc1ccc(CNc2cccnc2C)c(C)c1
InChIInChI=1S/C15H18N2/c1-11-6-7-14(12(2)9-11)10-17-15-5-4-8-16-13(15)3/h4-9,17H,10H2,1-3H3
InChIKeyUXWHLFXKJYPQSI-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.62
Rot. Bonds3

About N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine

N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine (PubChem CID 79041859) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine.

Molecular Properties

Compound NameN-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine
PubChem CID79041859
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC NameN-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine
SMILESCc1ccc(CNc2cccnc2C)c(C)c1
InChIInChI=1S/C15H18N2/c1-11-6-7-14(12(2)9-11)10-17-15-5-4-8-16-13(15)3/h4-9,17H,10H2,1-3H3
InChIKeyUXWHLFXKJYPQSI-UHFFFAOYSA-N
XLogP3.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(4-methylphenyl)methyl]pyridin-3-amine
CID 79041910
2-[[(2-methyl-3-pyridinyl)amino]methyl]phenol
CID 79042521
N-[(4-chloro-2-fluorophenyl)methyl]-2-methylpyridin-3-amine
CID 114842458
2-N-[(2,4-dimethylphenyl)methyl]benzene-1,2-diamine
CID 115124442
[2-[(2,4-dimethylphenyl)methylamino]phenyl]methanol
CID 43743124
2-bromo-N-[(2,5-dimethylphenyl)methyl]pyridin-3-amine
CID 114051454
N-[(2,4-dimethylphenyl)methyl]-2-pyrazol-1-ylaniline
CID 43705670
3-N-[(4-chloro-2-methylphenyl)methyl]-2-N,2-N-dimethylpyridine-2,3-diamine
CID 103275724
N-[[2-(methoxymethyl)phenyl]methyl]-2-methylpyridin-3-amine
CID 79041996
2-bromo-N-[(2,4-dimethylphenyl)methyl]-5-methylaniline
CID 82761087
1-N-[(2,4-dimethylphenyl)methyl]-3-fluorobenzene-1,2-diamine
CID 115127074
N-[(2,4-dimethylphenyl)methyl]-2-methylpropan-2-amine
CID 16774947

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine?
The IUPAC name of N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine (CID 79041859) is N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine.
What is the SMILES notation for N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine?
The canonical SMILES for N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine is Cc1ccc(CNc2cccnc2C)c(C)c1.
What is the InChIKey of N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine?
The InChIKey is UXWHLFXKJYPQSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-11-6-7-14(12(2)9-11)10-17-15-5-4-8-16-13(15)3/h4-9,17H,10H2,1-3H3.
What are the key properties of N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine?
N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine has a molecular weight of 226.32 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine is sourced from PubChem (CID 79041859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).