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

C14H16N2 — CID 96612968

IUPAC4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine
SMILESCc1ccc(Cc2ccncc2N)c(C)c1
InChIInChI=1S/C14H16N2/c1-10-3-4-12(11(2)7-10)8-13-5-6-16-9-14(13)15/h3-7,9H,8,15H2,1-2H3
InChIKeyIBVLXQUVOSDVRK-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.87
Rot. Bonds2

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

4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine (PubChem CID 96612968) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine
PubChem CID96612968
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine
SMILESCc1ccc(Cc2ccncc2N)c(C)c1
InChIInChI=1S/C14H16N2/c1-10-3-4-12(11(2)7-10)8-13-5-6-16-9-14(13)15/h3-7,9H,8,15H2,1-2H3
InChIKeyIBVLXQUVOSDVRK-UHFFFAOYSA-N
XLogP2.87
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,4-dimethylphenyl)pyridin-3-amine
CID 80503034
4-[(4-ethylphenyl)methyl]pyridin-3-amine
CID 96612961
1-(2,4-dimethylphenyl)-N-[(4-methyl-3-pyridinyl)methyl]methanamine
CID 114954748
[3-[(2,4-dimethylphenyl)methylamino]-4-pyridinyl]methanol
CID 71845475
5-methyl-2-(quinolin-4-ylmethyl)aniline
CID 82766689
4-(2,5-dimethylphenyl)sulfanylpyridin-3-amine
CID 28890544
3-[(2,3-difluoro-4-methylphenyl)methyl]pyridin-4-amine
CID 107514276
3-chloro-4-[5-[(2,4-dimethylphenyl)methyl]-1H-pyrazol-3-yl]pyridine
CID 69309763
4-(2-aminoethyl)pyridin-3-amine
CID 55254309
2-amino-4-methyl-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114701849
N-(3-amino-4-pyridinyl)-2,4-dimethylbenzamide
CID 63062252
2-(chloromethyl)-5-methylaniline
CID 91883475

Frequently Asked Questions

What is the IUPAC name of 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine?
The IUPAC name of 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine (CID 96612968) is 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine.
What is the SMILES notation for 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine?
The canonical SMILES for 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine is Cc1ccc(Cc2ccncc2N)c(C)c1.
What is the InChIKey of 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine?
The InChIKey is IBVLXQUVOSDVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-10-3-4-12(11(2)7-10)8-13-5-6-16-9-14(13)15/h3-7,9H,8,15H2,1-2H3.
What are the key properties of 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine?
4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine has a molecular weight of 212.30 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,4-dimethylphenyl)methyl]pyridin-3-amine is sourced from PubChem (CID 96612968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).