(7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one

C20H19N5O3 — CID 57424930

IUPAC(7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
SMILESCOc1ccc(-c2cccc(OC)n2)c([C@H]2Cc3nc(N)ncc3C(=O)N2)c1
InChIInChI=1S/C20H19N5O3/c1-27-11-6-7-12(15-4-3-5-18(23-15)28-2)13(8-11)16-9-17-14(19(26)24-16)10-22-20(21)25-17/h3-8,10,16H,9H2,1-2H3,(H,24,26)(H2,21,22,25)/t16-/m1/s1
InChIKeyAUQYWVAXPGOCIO-MRXNPFEDSA-N
MW377.40 g/mol
LogP2.17
Rot. Bonds4

About (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one

(7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one (PubChem CID 57424930) has the molecular formula C20H19N5O3 and a molecular weight of 377.40 g/mol. Its IUPAC name is (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one.

Molecular Properties

Compound Name(7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
PubChem CID57424930
Molecular FormulaC20H19N5O3
Molecular Weight377.40 g/mol
Exact Mass377.15
IUPAC Name(7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
SMILESCOc1ccc(-c2cccc(OC)n2)c([C@H]2Cc3nc(N)ncc3C(=O)N2)c1
InChIInChI=1S/C20H19N5O3/c1-27-11-6-7-12(15-4-3-5-18(23-15)28-2)13(8-11)16-9-17-14(19(26)24-16)10-22-20(21)25-17/h3-8,10,16H,9H2,1-2H3,(H,24,26)(H2,21,22,25)/t16-/m1/s1
InChIKeyAUQYWVAXPGOCIO-MRXNPFEDSA-N
XLogP2.17
TPSA112.25 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.40
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?
The IUPAC name of (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one (CID 57424930) is (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one.
What is the SMILES notation for (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?
The canonical SMILES for (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one is COc1ccc(-c2cccc(OC)n2)c([C@H]2Cc3nc(N)ncc3C(=O)N2)c1.
What is the InChIKey of (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?
The InChIKey is AUQYWVAXPGOCIO-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H19N5O3/c1-27-11-6-7-12(15-4-3-5-18(23-15)28-2)13(8-11)16-9-17-14(19(26)24-16)10-22-20(21)25-17/h3-8,10,16H,9H2,1-2H3,(H,24,26)(H2,21,22,25)/t16-/m1/s1.
What are the key properties of (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?
(7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one has a molecular weight of 377.40 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-2-amino-7-[5-methoxy-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one is sourced from PubChem (CID 57424930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).