5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine

C19H19N3 — CID 3233983

IUPAC5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine
SMILESCc1cccc(CNc2ncncc2-c2ccccc2C)c1
InChIInChI=1S/C19H19N3/c1-14-6-5-8-16(10-14)11-21-19-18(12-20-13-22-19)17-9-4-3-7-15(17)2/h3-10,12-13H,11H2,1-2H3,(H,20,21,22)
InChIKeyOJPIODKKYIWLDI-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.37
Rot. Bonds4

About 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine

5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine (PubChem CID 3233983) has the molecular formula C19H19N3 and a molecular weight of 289.38 g/mol. Its IUPAC name is 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine
PubChem CID3233983
Molecular FormulaC19H19N3
Molecular Weight289.38 g/mol
Exact Mass289.16
IUPAC Name5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine
SMILESCc1cccc(CNc2ncncc2-c2ccccc2C)c1
InChIInChI=1S/C19H19N3/c1-14-6-5-8-16(10-14)11-21-19-18(12-20-13-22-19)17-9-4-3-7-15(17)2/h3-10,12-13H,11H2,1-2H3,(H,20,21,22)
InChIKeyOJPIODKKYIWLDI-UHFFFAOYSA-N
XLogP4.37
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Msx-122
CID 11687907
5-Phenyl-2,4-pyrimidinediamine
CID 134761
4-[[4-[4-(2-Cyanoethyl)-2,6-dimethyl-anilino]pyrimidin-2-yl]amino]benzonitrile
CID 5270788
2-[(4-Cyanophenyl)amino]-4-[(2,4,6-trimethylphenyl)amino]pyrimidine-5-carbonitrile
CID 486388
4-({2-[(4-Cyanophenyl)amino]-5-methylpyrimidin-4-yl}amino)-3,5-dimethylbenzenecarbonitrile
CID 486392
5-Methyl-4-phenylpyrimidin-2-amine
CID 317238
5-((3-(Trifluoromethyl)phenyl)methyl)-2,4-pyrimidinediamine
CID 579834
(3S)-7-fluoro-3-pyridin-4-yl-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine
CID 46205968
5-fluoro-N,N'-bis(3-methylphenyl)pyrimidine-2,4-diamine
CID 802952
6-(2,6-Dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine
CID 5328116
2-N-[3-(diethylamino)propyl]-6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine
CID 5328118
6-Ethyl-5-{3-[3-(Pyrimidin-5-Yl)phenyl]prop-1-Yn-1-Yl}pyrimidine-2,4-Diamine
CID 71737834

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine?
The IUPAC name of 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine (CID 3233983) is 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine?
The canonical SMILES for 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine is Cc1cccc(CNc2ncncc2-c2ccccc2C)c1.
What is the InChIKey of 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine?
The InChIKey is OJPIODKKYIWLDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3/c1-14-6-5-8-16(10-14)11-21-19-18(12-20-13-22-19)17-9-4-3-7-15(17)2/h3-10,12-13H,11H2,1-2H3,(H,20,21,22).
What are the key properties of 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine?
5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine has a molecular weight of 289.38 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylphenyl)-N-[(3-methylphenyl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 3233983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).