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

C24H24N4O — CID 70288002

IUPAC6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(OCC(C)C)cc2)cc1
InChIInChI=1S/C24H24N4O/c1-15(2)13-29-19-10-8-18(9-11-19)22-20(17-6-4-16(3)5-7-17)12-21-23(25)26-14-27-24(21)28-22/h4-12,14-15H,13H2,1-3H3,(H2,25,26,27,28)
InChIKeyDUTGYONZBNWUFZ-UHFFFAOYSA-N
MW384.48 g/mol
LogP5.28
Rot. Bonds5

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

6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 70288002) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is 6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine
PubChem CID70288002
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(OCC(C)C)cc2)cc1
InChIInChI=1S/C24H24N4O/c1-15(2)13-29-19-10-8-18(9-11-19)22-20(17-6-4-16(3)5-7-17)12-21-23(25)26-14-27-24(21)28-22/h4-12,14-15H,13H2,1-3H3,(H2,25,26,27,28)
InChIKeyDUTGYONZBNWUFZ-UHFFFAOYSA-N
XLogP5.28
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[4-(2-methylpropoxy)phenyl]pyrimidin-4-amine
CID 82293784
4-[4-(2-methylpropoxy)phenyl]phthalazin-1-amine
CID 82192731
7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine
CID 10133746
5-methyl-3-[4-(2-methylpropoxy)phenyl]-1H-pyrazol-4-amine
CID 82479094
4-[4-(2-methylpropoxy)phenyl]-1H-pyrazol-5-amine
CID 61393233
[5-methyl-4-[4-(2-methylpropoxy)phenyl]-1,3-oxazol-2-yl]methanamine
CID 95466695
(2S)-3-methyl-1-(4-methylphenoxy)butan-2-amine
CID 39109844
2-amino-4-methyl-6-[4-(2-methylpropoxy)phenyl]pyrimidine-5-carbohydrazide
CID 54851412
2-[2-amino-5-[4-(2-methylpropoxy)phenyl]pyrimidin-4-yl]phenol
CID 135960781
ethyl 2-amino-4-methyl-6-[4-(2-methylpropoxy)phenyl]pyrimidine-5-carboxylate
CID 54851374
[4-methyl-3-[4-(2-methylpropoxy)phenyl]-1H-pyrazol-5-yl]methanamine
CID 54847041
6-benzyl-7-[4-(dimethylamino)phenyl]pyrido[2,3-d]pyrimidin-4-amine
CID 10291751

Frequently Asked Questions

What is the IUPAC name of 6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine (CID 70288002) is 6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine is Cc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(OCC(C)C)cc2)cc1.
What is the InChIKey of 6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is DUTGYONZBNWUFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c1-15(2)13-29-19-10-8-18(9-11-19)22-20(17-6-4-16(3)5-7-17)12-21-23(25)26-14-27-24(21)28-22/h4-12,14-15H,13H2,1-3H3,(H2,25,26,27,28).
What are the key properties of 6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine?
6-(4-methylphenyl)-7-[4-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 384.48 g/mol, XLogP of 5.28, 5 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-(2-methylpropoxy)phenyl]pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 70288002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).