6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine

C27H21N5 — CID 10273318

IUPAC6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(/C=C/c3ccccn3)cc2)cc1
InChIInChI=1S/C27H21N5/c1-18-5-10-20(11-6-18)23-16-24-26(28)30-17-31-27(24)32-25(23)21-12-7-19(8-13-21)9-14-22-4-2-3-15-29-22/h2-17H,1H3,(H2,28,30,31,32)/b14-9+
InChIKeyFMCJKBDHGIEHMU-NTEUORMPSA-N
MW415.50 g/mol
LogP5.81
Rot. Bonds4

About 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine

6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 10273318) has the molecular formula C27H21N5 and a molecular weight of 415.50 g/mol. Its IUPAC name is 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine
PubChem CID10273318
Molecular FormulaC27H21N5
Molecular Weight415.50 g/mol
Exact Mass415.18
IUPAC Name6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(/C=C/c3ccccn3)cc2)cc1
InChIInChI=1S/C27H21N5/c1-18-5-10-20(11-6-18)23-16-24-26(28)30-17-31-27(24)32-25(23)21-12-7-19(8-13-21)9-14-22-4-2-3-15-29-22/h2-17H,1H3,(H2,28,30,31,32)/b14-9+
InChIKeyFMCJKBDHGIEHMU-NTEUORMPSA-N
XLogP5.81
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.50
LogP ≤ 55.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Ngd-8243
CID 11247522
Sri-9439
CID 446752
N-(6-(4-(trifluoromethyl)phenyl)pyrimidin-4-yl)quinolin-7-amine
CID 10248318
Cyclohexyl-(4-(1-piperazin-1-yl(2,6)naphthyridin-3-yl)pyridin-2-yl)amine
CID 25020250
Pik-iii
CID 67983123
N2-methyl-N4-(pyrimidin-2-ylmethyl)-5-(quinolin-6-yl)-7H-pyrrolo(2,3-d)pyrimidine-2,4-diamine
CID 133082038
[N-(2,4-Diaminopteridin-6-YL)-methyl]-dibenz[B,F]azepine
CID 446744
N-benzyl-2-(pyridin-3-yl)quinazolin-4-amine
CID 667555
2-(6-methylpyridin-2-yl)-N-(pyridin-4-yl)quinazolin-4-amine
CID 10267580
(NE)-N-[(7S)-2-amino-7-(4-fluoro-2-pyridin-3-ylphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-ylidene]hydroxylamine
CID 46937132
N-benzyl-2-pyridin-4-ylquinazolin-4-amine
CID 921562
N-(4-methylphenyl)-4-quinolin-4-ylpyrimidin-2-amine
CID 44820374

Frequently Asked Questions

What is the IUPAC name of 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine (CID 10273318) is 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine is Cc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(/C=C/c3ccccn3)cc2)cc1.
What is the InChIKey of 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is FMCJKBDHGIEHMU-NTEUORMPSA-N. The full InChI is InChI=1S/C27H21N5/c1-18-5-10-20(11-6-18)23-16-24-26(28)30-17-31-27(24)32-25(23)21-12-7-19(8-13-21)9-14-22-4-2-3-15-29-22/h2-17H,1H3,(H2,28,30,31,32)/b14-9+.
What are the key properties of 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine?
6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 415.50 g/mol, XLogP of 5.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylphenyl)-7-[4-[(E)-2-pyridin-2-ylethenyl]phenyl]pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 10273318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).