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

C20H15ClN4O — CID 19256952

IUPAC5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1ccccc1-c1cc(-c2ccccc2Cl)c2c(N)ncnc2n1
InChIInChI=1S/C20H15ClN4O/c1-26-17-9-5-3-7-13(17)16-10-14(12-6-2-4-8-15(12)21)18-19(22)23-11-24-20(18)25-16/h2-11H,1H3,(H2,22,23,24,25)
InChIKeyHCDSNDMWUCYQKD-UHFFFAOYSA-N
MW362.82 g/mol
LogP4.60
Rot. Bonds3

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

5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 19256952) has the molecular formula C20H15ClN4O and a molecular weight of 362.82 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
PubChem CID19256952
Molecular FormulaC20H15ClN4O
Molecular Weight362.82 g/mol
Exact Mass362.09
IUPAC Name5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1ccccc1-c1cc(-c2ccccc2Cl)c2c(N)ncnc2n1
InChIInChI=1S/C20H15ClN4O/c1-26-17-9-5-3-7-13(17)16-10-14(12-6-2-4-8-15(12)21)18-19(22)23-11-24-20(18)25-16/h2-11H,1H3,(H2,22,23,24,25)
InChIKeyHCDSNDMWUCYQKD-UHFFFAOYSA-N
XLogP4.60
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.82
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (CID 19256952) is 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is COc1ccccc1-c1cc(-c2ccccc2Cl)c2c(N)ncnc2n1.
What is the InChIKey of 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is HCDSNDMWUCYQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O/c1-26-17-9-5-3-7-13(17)16-10-14(12-6-2-4-8-15(12)21)18-19(22)23-11-24-20(18)25-16/h2-11H,1H3,(H2,22,23,24,25).
What are the key properties of 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 362.82 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 19256952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).