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

C22H21N5O — CID 10270557

IUPAC7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C22H21N5O/c1-27(2)16-8-4-15(5-9-16)20-18(14-6-10-17(28-3)11-7-14)12-19-21(23)24-13-25-22(19)26-20/h4-13H,1-3H3,(H2,23,24,25,26)
InChIKeyZADGRKLNRFXWQT-UHFFFAOYSA-N
MW371.44 g/mol
LogP4.02
Rot. Bonds4

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

7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 10270557) has the molecular formula C22H21N5O and a molecular weight of 371.44 g/mol. Its IUPAC name is 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
PubChem CID10270557
Molecular FormulaC22H21N5O
Molecular Weight371.44 g/mol
Exact Mass371.17
IUPAC Name7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C22H21N5O/c1-27(2)16-8-4-15(5-9-16)20-18(14-6-10-17(28-3)11-7-14)12-19-21(23)24-13-25-22(19)26-20/h4-13H,1-3H3,(H2,23,24,25,26)
InChIKeyZADGRKLNRFXWQT-UHFFFAOYSA-N
XLogP4.02
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)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

Frequently Asked Questions

What is the IUPAC name of 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (CID 10270557) is 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is COc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(N(C)C)cc2)cc1.
What is the InChIKey of 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is ZADGRKLNRFXWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5O/c1-27(2)16-8-4-15(5-9-16)20-18(14-6-10-17(28-3)11-7-14)12-19-21(23)24-13-25-22(19)26-20/h4-13H,1-3H3,(H2,23,24,25,26).
What are the key properties of 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 371.44 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(dimethylamino)phenyl]-6-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 10270557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).