4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one

C19H19N3O3 — CID 70749955

IUPAC4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1ccc2c(c1)C(C(=O)N1CCc3ncccc3C1)CC(=O)N2
InChIInChI=1S/C19H19N3O3/c1-25-13-4-5-17-14(9-13)15(10-18(23)21-17)19(24)22-8-6-16-12(11-22)3-2-7-20-16/h2-5,7,9,15H,6,8,10-11H2,1H3,(H,21,23)
InChIKeyBMLPUESKORHEOT-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.10
Rot. Bonds2

About 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one

4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one (PubChem CID 70749955) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one
PubChem CID70749955
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1ccc2c(c1)C(C(=O)N1CCc3ncccc3C1)CC(=O)N2
InChIInChI=1S/C19H19N3O3/c1-25-13-4-5-17-14(9-13)15(10-18(23)21-17)19(24)22-8-6-16-12(11-22)3-2-7-20-16/h2-5,7,9,15H,6,8,10-11H2,1H3,(H,21,23)
InChIKeyBMLPUESKORHEOT-UHFFFAOYSA-N
XLogP2.10
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one (CID 70749955) is 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one is COc1ccc2c(c1)C(C(=O)N1CCc3ncccc3C1)CC(=O)N2.
What is the InChIKey of 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is BMLPUESKORHEOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-25-13-4-5-17-14(9-13)15(10-18(23)21-17)19(24)22-8-6-16-12(11-22)3-2-7-20-16/h2-5,7,9,15H,6,8,10-11H2,1H3,(H,21,23).
What are the key properties of 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one?
4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 337.38 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)-6-methoxy-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 70749955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).