7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one

C24H21N5O2 — CID 71181163

IUPAC7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one
SMILESCOc1ccc2nc(-c3cccnc3)nc(Nc3ccc4c(c3)N(C)C(=O)CC4)c2c1
InChIInChI=1S/C24H21N5O2/c1-29-21-12-17(7-5-15(21)6-10-22(29)30)26-24-19-13-18(31-2)8-9-20(19)27-23(28-24)16-4-3-11-25-14-16/h3-5,7-9,11-14H,6,10H2,1-2H3,(H,26,27,28)
InChIKeyAFLXFSPIGVODQN-UHFFFAOYSA-N
MW411.47 g/mol
LogP4.35
Rot. Bonds4

About 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one

7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one (PubChem CID 71181163) has the molecular formula C24H21N5O2 and a molecular weight of 411.47 g/mol. Its IUPAC name is 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one
PubChem CID71181163
Molecular FormulaC24H21N5O2
Molecular Weight411.47 g/mol
Exact Mass411.17
IUPAC Name7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one
SMILESCOc1ccc2nc(-c3cccnc3)nc(Nc3ccc4c(c3)N(C)C(=O)CC4)c2c1
InChIInChI=1S/C24H21N5O2/c1-29-21-12-17(7-5-15(21)6-10-22(29)30)26-24-19-13-18(31-2)8-9-20(19)27-23(28-24)16-4-3-11-25-14-16/h3-5,7-9,11-14H,6,10H2,1-2H3,(H,26,27,28)
InChIKeyAFLXFSPIGVODQN-UHFFFAOYSA-N
XLogP4.35
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.47
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one with MolForge

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Related Compounds

7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]chromen-2-one
CID 89417197
6-methoxy-2-pyridin-3-yl-N-quinolin-6-ylquinazolin-4-amine
CID 71274406
2-methoxy-N-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-1,3-benzoxazol-6-amine
CID 71180927
N-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-1,3-benzothiazol-6-amine
CID 71273583
N-(4-chloro-3-methylphenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 71274391
7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-4H-1,4-benzoxazin-3-one
CID 71180918
6-methoxy-N-[3-(1,3-oxazol-2-yl)phenyl]-2-pyridin-3-ylquinazolin-4-amine
CID 71180917
6-methoxy-N-(1-methylindol-2-yl)-2-pyridin-3-ylquinazolin-4-amine
CID 71181123
N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 71274367
N-(2-fluorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 67298112
6-chloro-N-(3-methoxy-4-methylphenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 71274424
N-(3,4-dichlorophenyl)-6-methoxy-2-pyridazin-4-ylquinazolin-4-amine
CID 71180462

Frequently Asked Questions

What is the IUPAC name of 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one (CID 71181163) is 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one is COc1ccc2nc(-c3cccnc3)nc(Nc3ccc4c(c3)N(C)C(=O)CC4)c2c1.
What is the InChIKey of 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one?
The InChIKey is AFLXFSPIGVODQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O2/c1-29-21-12-17(7-5-15(21)6-10-22(29)30)26-24-19-13-18(31-2)8-9-20(19)27-23(28-24)16-4-3-11-25-14-16/h3-5,7-9,11-14H,6,10H2,1-2H3,(H,26,27,28).
What are the key properties of 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one?
7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one has a molecular weight of 411.47 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]-1-methyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 71181163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).