3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide

C20H23N3O5 — CID 110310874

IUPAC3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
SMILESCOc1cc2cc(CCC(=O)NCCc3cc(C)on3)c(=O)[nH]c2cc1OC
InChIInChI=1S/C20H23N3O5/c1-12-8-15(23-28-12)6-7-21-19(24)5-4-13-9-14-10-17(26-2)18(27-3)11-16(14)22-20(13)25/h8-11H,4-7H2,1-3H3,(H,21,24)(H,22,25)
InChIKeySCHHEBNUQUISDY-UHFFFAOYSA-N
MW385.42 g/mol
LogP2.13
Rot. Bonds8

About 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide

3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide (PubChem CID 110310874) has the molecular formula C20H23N3O5 and a molecular weight of 385.42 g/mol. Its IUPAC name is 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
PubChem CID110310874
Molecular FormulaC20H23N3O5
Molecular Weight385.42 g/mol
Exact Mass385.16
IUPAC Name3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
SMILESCOc1cc2cc(CCC(=O)NCCc3cc(C)on3)c(=O)[nH]c2cc1OC
InChIInChI=1S/C20H23N3O5/c1-12-8-15(23-28-12)6-7-21-19(24)5-4-13-9-14-10-17(26-2)18(27-3)11-16(14)22-20(13)25/h8-11H,4-7H2,1-3H3,(H,21,24)(H,22,25)
InChIKeySCHHEBNUQUISDY-UHFFFAOYSA-N
XLogP2.13
TPSA106.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-(3-methylbutyl)propanamide
CID 110298971
3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-(4,4-dimethylpentyl)propanamide
CID 110617828
3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-(2-methylpropyl)propanamide
CID 110298935
N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110608950
N-[2-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)ethyl]-4-methylbenzamide
CID 110326114
N-[2-(4-methoxyphenyl)ethyl]-3-(7-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331176
N-[2-(dimethylamino)ethyl]-3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331619
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 110331644
N-[2-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)ethyl]-1,3-benzodioxole-5-carboxamide
CID 110326136
N-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 110324982
4-chloro-N-[2-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)ethyl]benzamide
CID 110326133
3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-(2-propan-2-yloxyethyl)propanamide
CID 110418808

Frequently Asked Questions

What is the IUPAC name of 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide?
The IUPAC name of 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide (CID 110310874) is 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide.
What is the SMILES notation for 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide?
The canonical SMILES for 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide is COc1cc2cc(CCC(=O)NCCc3cc(C)on3)c(=O)[nH]c2cc1OC.
What is the InChIKey of 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide?
The InChIKey is SCHHEBNUQUISDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O5/c1-12-8-15(23-28-12)6-7-21-19(24)5-4-13-9-14-10-17(26-2)18(27-3)11-16(14)22-20(13)25/h8-11H,4-7H2,1-3H3,(H,21,24)(H,22,25).
What are the key properties of 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide?
3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide has a molecular weight of 385.42 g/mol, XLogP of 2.13, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide is sourced from PubChem (CID 110310874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).