N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine

C21H25N7O2 — CID 167049785

IUPACN-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine
SMILESCOc1nc2c(cc1Nc1ncc3ccnc(N4CCOCC4)c3n1)CN(C)CC2
InChIInChI=1S/C21H25N7O2/c1-27-6-4-16-15(13-27)11-17(20(24-16)29-2)25-21-23-12-14-3-5-22-19(18(14)26-21)28-7-9-30-10-8-28/h3,5,11-12H,4,6-10,13H2,1-2H3,(H,23,25,26)
InChIKeyPCPHJRNIVJNKOS-UHFFFAOYSA-N
MW407.48 g/mol
LogP2.00
Rot. Bonds4

About N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine

N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine (PubChem CID 167049785) has the molecular formula C21H25N7O2 and a molecular weight of 407.48 g/mol. Its IUPAC name is N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine.

Molecular Properties

Compound NameN-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine
PubChem CID167049785
Molecular FormulaC21H25N7O2
Molecular Weight407.48 g/mol
Exact Mass407.21
IUPAC NameN-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine
SMILESCOc1nc2c(cc1Nc1ncc3ccnc(N4CCOCC4)c3n1)CN(C)CC2
InChIInChI=1S/C21H25N7O2/c1-27-6-4-16-15(13-27)11-17(20(24-16)29-2)25-21-23-12-14-3-5-22-19(18(14)26-21)28-7-9-30-10-8-28/h3,5,11-12H,4,6-10,13H2,1-2H3,(H,23,25,26)
InChIKeyPCPHJRNIVJNKOS-UHFFFAOYSA-N
XLogP2.00
TPSA88.53 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.48
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-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 N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine?
The IUPAC name of N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine (CID 167049785) is N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine.
What is the SMILES notation for N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine?
The canonical SMILES for N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine is COc1nc2c(cc1Nc1ncc3ccnc(N4CCOCC4)c3n1)CN(C)CC2.
What is the InChIKey of N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine?
The InChIKey is PCPHJRNIVJNKOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N7O2/c1-27-6-4-16-15(13-27)11-17(20(24-16)29-2)25-21-23-12-14-3-5-22-19(18(14)26-21)28-7-9-30-10-8-28/h3,5,11-12H,4,6-10,13H2,1-2H3,(H,23,25,26).
What are the key properties of N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine?
N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine has a molecular weight of 407.48 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-8-morpholin-4-ylpyrido[3,4-d]pyrimidin-2-amine is sourced from PubChem (CID 167049785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).