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

C23H22N4O4 — CID 19256895

IUPAC5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1ccccc1-c1cc(-c2cc(OC)c(OC)c(OC)c2)nc2ncnc(N)c12
InChIInChI=1S/C23H22N4O4/c1-28-17-8-6-5-7-14(17)15-11-16(27-23-20(15)22(24)25-12-26-23)13-9-18(29-2)21(31-4)19(10-13)30-3/h5-12H,1-4H3,(H2,24,25,26,27)
InChIKeyGVYNSWVVFOBMQV-UHFFFAOYSA-N
MW418.45 g/mol
LogP3.98
Rot. Bonds6

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

5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 19256895) has the molecular formula C23H22N4O4 and a molecular weight of 418.45 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
PubChem CID19256895
Molecular FormulaC23H22N4O4
Molecular Weight418.45 g/mol
Exact Mass418.16
IUPAC Name5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCOc1ccccc1-c1cc(-c2cc(OC)c(OC)c(OC)c2)nc2ncnc(N)c12
InChIInChI=1S/C23H22N4O4/c1-28-17-8-6-5-7-14(17)15-11-16(27-23-20(15)22(24)25-12-26-23)13-9-18(29-2)21(31-4)19(10-13)30-3/h5-12H,1-4H3,(H2,24,25,26,27)
InChIKeyGVYNSWVVFOBMQV-UHFFFAOYSA-N
XLogP3.98
TPSA101.61 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

5-(2-methoxyphenyl)-7-(4-methylphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257018
5-(3-bromo-4,5-dimethoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256954
5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256952
5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256949
7-(4-methylphenyl)-5-(2,3,4-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257016
7-(3-methoxyphenyl)-5-(2,3,4-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257027
7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256900
7-(2,5-dimethoxyphenyl)-5-(4-ethoxy-3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257056
7-methyl-6-propan-2-yl-5-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257070
5-(3-bromophenyl)-7-phenylpyrido[2,3-d]pyrimidin-4-amine
CID 54384444
6-(2,3-dimethoxyphenyl)-5-methoxypyrimidin-4-amine
CID 82794447
5-(3-bromophenyl)-7-(4-fluorophenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 54389329

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (CID 19256895) is 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is COc1ccccc1-c1cc(-c2cc(OC)c(OC)c(OC)c2)nc2ncnc(N)c12.
What is the InChIKey of 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is GVYNSWVVFOBMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O4/c1-28-17-8-6-5-7-14(17)15-11-16(27-23-20(15)22(24)25-12-26-23)13-9-18(29-2)21(31-4)19(10-13)30-3/h5-12H,1-4H3,(H2,24,25,26,27).
What are the key properties of 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 418.45 g/mol, XLogP of 3.98, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 19256895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).