4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine

C14H13N5O — CID 5328061

IUPAC4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine
SMILESCOc1cccc(Nc2ncnc3cc(N)ncc23)c1
InChIInChI=1S/C14H13N5O/c1-20-10-4-2-3-9(5-10)19-14-11-7-16-13(15)6-12(11)17-8-18-14/h2-8H,1H3,(H2,15,16)(H,17,18,19)
InChIKeyCVTRQPCTVZAMDM-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.36
Rot. Bonds3

About 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine

4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine (PubChem CID 5328061) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine.

Molecular Properties

Compound Name4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine
PubChem CID5328061
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC Name4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine
SMILESCOc1cccc(Nc2ncnc3cc(N)ncc23)c1
InChIInChI=1S/C14H13N5O/c1-20-10-4-2-3-9(5-10)19-14-11-7-16-13(15)6-12(11)17-8-18-14/h2-8H,1H3,(H2,15,16)(H,17,18,19)
InChIKeyCVTRQPCTVZAMDM-UHFFFAOYSA-N
XLogP2.36
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-Methoxyquinazoline
CID 12213273
6,7-dimethoxy-N-phenylquinazolin-4-amine
CID 3798
6,7-dimethoxy-N-(3-methoxyphenyl)quinazolin-4-amine
CID 2808988
N-[(4-methoxyphenyl)methyl]quinazolin-4-amine
CID 5328015
2,4-Quinazolinediamine, 5-methoxy-
CID 213752
6-{[(2,5-Diethoxyphenyl)amino]methyl}-5-Methylpyrido[2,3-D]pyrimidine-2,4-Diamine
CID 457349
4-[2-(ethylamino)pyrido[3,2-d]pyrimidin-4-yl]-7-methoxy-3,4-dihydroquinoxalin-2(1H)-one
CID 156599543
2-(7-Methoxy-4-methylquinazolin-2-yl)guanidine
CID 2835211
N-(3-bromophenyl)-7-methoxypyrido[4,3-d]pyrimidin-4-amine
CID 5328254
N-(3-bromophenyl)-6-methoxypyrido[3,4-d]pyrimidin-4-amine
CID 5328262
4-N-(3-bromophenyl)-6-N-[(4-methoxyphenyl)methyl]pyrido[3,4-d]pyrimidine-4,6-diamine
CID 5328263
N-(4-methoxyphenyl)-2-pyridin-4-ylquinazolin-4-amine
CID 877998

Frequently Asked Questions

What is the IUPAC name of 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine?
The IUPAC name of 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine (CID 5328061) is 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine.
What is the SMILES notation for 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine?
The canonical SMILES for 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine is COc1cccc(Nc2ncnc3cc(N)ncc23)c1.
What is the InChIKey of 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine?
The InChIKey is CVTRQPCTVZAMDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-20-10-4-2-3-9(5-10)19-14-11-7-16-13(15)6-12(11)17-8-18-14/h2-8H,1H3,(H2,15,16)(H,17,18,19).
What are the key properties of 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine?
4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine has a molecular weight of 267.29 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine is sourced from PubChem (CID 5328061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).