7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine

C22H20N4O3 — CID 19256900

IUPAC7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1cccc(-c2cc(-c3ccc(OC)c(OC)c3)nc3ncnc(N)c23)c1
InChIInChI=1S/C22H20N4O3/c1-27-15-6-4-5-13(9-15)16-11-17(26-22-20(16)21(23)24-12-25-22)14-7-8-18(28-2)19(10-14)29-3/h4-12H,1-3H3,(H2,23,24,25,26)
InChIKeyHKNGLPXZHFAIPH-UHFFFAOYSA-N
MW388.43 g/mol
LogP3.97
Rot. Bonds5

About 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine

7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 19256900) has the molecular formula C22H20N4O3 and a molecular weight of 388.43 g/mol. Its IUPAC name is 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
PubChem CID19256900
Molecular FormulaC22H20N4O3
Molecular Weight388.43 g/mol
Exact Mass388.15
IUPAC Name7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1cccc(-c2cc(-c3ccc(OC)c(OC)c3)nc3ncnc(N)c23)c1
InChIInChI=1S/C22H20N4O3/c1-27-15-6-4-5-13(9-15)16-11-17(26-22-20(16)21(23)24-12-25-22)14-7-8-18(28-2)19(10-14)29-3/h4-12H,1-3H3,(H2,23,24,25,26)
InChIKeyHKNGLPXZHFAIPH-UHFFFAOYSA-N
XLogP3.97
TPSA92.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.43
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

7-(3-methoxyphenyl)-5-(2,3,4-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257027
7-(2,5-dimethoxyphenyl)-5-(4-ethoxy-3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257056
5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256949
5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256895
6-(3,4-dimethoxyphenyl)-7-(5-methoxy-2-pyridinyl)-5-phenylpyrido[2,3-d]pyrimidin-4-amine
CID 19353455
5-(2-methoxyphenyl)-7-(4-methylphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257018
2-amino-4-(4-ethoxy-3-methoxyphenyl)-6-(3-methoxyphenyl)pyridine-3-carbonitrile
CID 5119915
6-(3,4-dimethoxyphenyl)-7-(5-methoxy-2-pyridinyl)-5-phenylpyrido[2,3-d]pyrimidin-4-amine;hydrochloride
CID 162334062
7-(4-methylphenyl)-5-(2,3,4-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257016
5-(3,5-dimethoxyphenyl)-7-thiophen-2-ylpyrido[2,3-d]pyrimidin-4-amine
CID 70289464
5-(3-bromophenyl)-7-phenylpyrido[2,3-d]pyrimidin-4-amine
CID 54384444
5-(3-bromophenyl)-7-(4-fluorophenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 54389329

Frequently Asked Questions

What is the IUPAC name of 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (CID 19256900) is 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is COc1cccc(-c2cc(-c3ccc(OC)c(OC)c3)nc3ncnc(N)c23)c1.
What is the InChIKey of 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is HKNGLPXZHFAIPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O3/c1-27-15-6-4-5-13(9-15)16-11-17(26-22-20(16)21(23)24-12-25-22)14-7-8-18(28-2)19(10-14)29-3/h4-12H,1-3H3,(H2,23,24,25,26).
What are the key properties of 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 388.43 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 19256900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).