4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine

C24H28N6O2 — CID 155556576

IUPAC4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine
SMILESCOc1ncc(N2CCc3ncnc(-c4ccnc(NC5CCOCC5)c4)c3C2)cc1C
InChIInChI=1S/C24H28N6O2/c1-16-11-19(13-26-24(16)31-2)30-8-4-21-20(14-30)23(28-15-27-21)17-3-7-25-22(12-17)29-18-5-9-32-10-6-18/h3,7,11-13,15,18H,4-6,8-10,14H2,1-2H3,(H,25,29)
InChIKeyUJCSDSDXMJZRJS-UHFFFAOYSA-N
MW432.53 g/mol
LogP3.40
Rot. Bonds5

About 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine

4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine (PubChem CID 155556576) has the molecular formula C24H28N6O2 and a molecular weight of 432.53 g/mol. Its IUPAC name is 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine
PubChem CID155556576
Molecular FormulaC24H28N6O2
Molecular Weight432.53 g/mol
Exact Mass432.23
IUPAC Name4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine
SMILESCOc1ncc(N2CCc3ncnc(-c4ccnc(NC5CCOCC5)c4)c3C2)cc1C
InChIInChI=1S/C24H28N6O2/c1-16-11-19(13-26-24(16)31-2)30-8-4-21-20(14-30)23(28-15-27-21)17-3-7-25-22(12-17)29-18-5-9-32-10-6-18/h3,7,11-13,15,18H,4-6,8-10,14H2,1-2H3,(H,25,29)
InChIKeyUJCSDSDXMJZRJS-UHFFFAOYSA-N
XLogP3.40
TPSA85.29 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.53
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine 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 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine?
The IUPAC name of 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine (CID 155556576) is 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine.
What is the SMILES notation for 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine?
The canonical SMILES for 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine is COc1ncc(N2CCc3ncnc(-c4ccnc(NC5CCOCC5)c4)c3C2)cc1C.
What is the InChIKey of 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine?
The InChIKey is UJCSDSDXMJZRJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O2/c1-16-11-19(13-26-24(16)31-2)30-8-4-21-20(14-30)23(28-15-27-21)17-3-7-25-22(12-17)29-18-5-9-32-10-6-18/h3,7,11-13,15,18H,4-6,8-10,14H2,1-2H3,(H,25,29).
What are the key properties of 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine?
4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine has a molecular weight of 432.53 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(6-methoxy-5-methyl-3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-N-(oxan-4-yl)pyridin-2-amine is sourced from PubChem (CID 155556576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).