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

C23H22N4O — CID 10133746

IUPAC7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(-c2nc3ncnc(N)c3cc2CCCc2ccccc2)cc1
InChIInChI=1S/C23H22N4O/c1-28-19-12-10-17(11-13-19)21-18(9-5-8-16-6-3-2-4-7-16)14-20-22(24)25-15-26-23(20)27-21/h2-4,6-7,10-15H,5,8-9H2,1H3,(H2,24,25,26,27)
InChIKeyLOUZSLNNZAHIGH-UHFFFAOYSA-N
MW370.46 g/mol
LogP4.46
Rot. Bonds6

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

7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 10133746) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine
PubChem CID10133746
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(-c2nc3ncnc(N)c3cc2CCCc2ccccc2)cc1
InChIInChI=1S/C23H22N4O/c1-28-19-12-10-17(11-13-19)21-18(9-5-8-16-6-3-2-4-7-16)14-20-22(24)25-15-26-23(20)27-21/h2-4,6-7,10-15H,5,8-9H2,1H3,(H2,24,25,26,27)
InChIKeyLOUZSLNNZAHIGH-UHFFFAOYSA-N
XLogP4.46
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine (CID 10133746) is 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine is COc1ccc(-c2nc3ncnc(N)c3cc2CCCc2ccccc2)cc1.
What is the InChIKey of 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is LOUZSLNNZAHIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O/c1-28-19-12-10-17(11-13-19)21-18(9-5-8-16-6-3-2-4-7-16)14-20-22(24)25-15-26-23(20)27-21/h2-4,6-7,10-15H,5,8-9H2,1H3,(H2,24,25,26,27).
What are the key properties of 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine?
7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 370.46 g/mol, XLogP of 4.46, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-methoxyphenyl)-6-(3-phenylpropyl)pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 10133746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).