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

C23H22N4O3 — CID 19256949

IUPAC5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCCOc1ccc(-c2cc(-c3ccccc3OC)nc3ncnc(N)c23)cc1OC
InChIInChI=1S/C23H22N4O3/c1-4-30-19-10-9-14(11-20(19)29-3)16-12-17(15-7-5-6-8-18(15)28-2)27-23-21(16)22(24)25-13-26-23/h5-13H,4H2,1-3H3,(H2,24,25,26,27)
InChIKeyGRQJIDDTZQXDLE-UHFFFAOYSA-N
MW402.45 g/mol
LogP4.36
Rot. Bonds6

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

5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 19256949) has the molecular formula C23H22N4O3 and a molecular weight of 402.45 g/mol. Its IUPAC name is 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
PubChem CID19256949
Molecular FormulaC23H22N4O3
Molecular Weight402.45 g/mol
Exact Mass402.17
IUPAC Name5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCCOc1ccc(-c2cc(-c3ccccc3OC)nc3ncnc(N)c23)cc1OC
InChIInChI=1S/C23H22N4O3/c1-4-30-19-10-9-14(11-20(19)29-3)16-12-17(15-7-5-6-8-18(15)28-2)27-23-21(16)22(24)25-13-26-23/h5-13H,4H2,1-3H3,(H2,24,25,26,27)
InChIKeyGRQJIDDTZQXDLE-UHFFFAOYSA-N
XLogP4.36
TPSA92.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.45
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

7-(2,5-dimethoxyphenyl)-5-(4-ethoxy-3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257056
5-(2-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256895
5-(3-bromo-4,5-dimethoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256954
5-(2-methoxyphenyl)-7-(4-methylphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257018
5-(2-chlorophenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256952
7-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19256900
3-(4-ethoxy-3-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 166787512
5-(4-bromophenyl)-N-butyl-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 171366922
6-(3,4-dimethoxyphenyl)-7-(5-methoxy-2-pyridinyl)-5-phenylpyrido[2,3-d]pyrimidin-4-amine
CID 19353455
7-(4-methylphenyl)-5-(2,3,4-trimethoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257016
5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine
CID 19257003
6-(3,4-dimethoxyphenyl)-7-(5-methoxy-2-pyridinyl)-5-phenylpyrido[2,3-d]pyrimidin-4-amine;hydrochloride
CID 162334062

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine (CID 19256949) is 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is CCOc1ccc(-c2cc(-c3ccccc3OC)nc3ncnc(N)c23)cc1OC.
What is the InChIKey of 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is GRQJIDDTZQXDLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O3/c1-4-30-19-10-9-14(11-20(19)29-3)16-12-17(15-7-5-6-8-18(15)28-2)27-23-21(16)22(24)25-13-26-23/h5-13H,4H2,1-3H3,(H2,24,25,26,27).
What are the key properties of 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine?
5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 402.45 g/mol, XLogP of 4.36, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxy-3-methoxyphenyl)-7-(2-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 19256949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).