3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide

C22H24N2O2 — CID 110331547

IUPAC3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide
SMILESCc1cc(C)c2[nH]c(=O)c(CCC(=O)NC(C)c3ccccc3)cc2c1
InChIInChI=1S/C22H24N2O2/c1-14-11-15(2)21-19(12-14)13-18(22(26)24-21)9-10-20(25)23-16(3)17-7-5-4-6-8-17/h4-8,11-13,16H,9-10H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyVZJMUQJVXKYHGA-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.95
Rot. Bonds5

About 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide

3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide (PubChem CID 110331547) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide.

Molecular Properties

Compound Name3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide
PubChem CID110331547
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide
SMILESCc1cc(C)c2[nH]c(=O)c(CCC(=O)NC(C)c3ccccc3)cc2c1
InChIInChI=1S/C22H24N2O2/c1-14-11-15(2)21-19(12-14)13-18(22(26)24-21)9-10-20(25)23-16(3)17-7-5-4-6-8-17/h4-8,11-13,16H,9-10H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyVZJMUQJVXKYHGA-UHFFFAOYSA-N
XLogP3.95
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331576
3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide
CID 110298844
3-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(1S)-1-phenylethyl]propanamide
CID 135954015
1-[2-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-phenylurea
CID 110326282
N-cyclopentyl-3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331527
3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(pyridin-4-ylmethyl)propanamide
CID 110331556
3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 110331560
1-(1,3-benzodioxol-5-ylmethyl)-1-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[(1R)-1-phenylethyl]thiourea
CID 1174855
N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 69445167
N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide
CID 54812168
N-(3-cyanophenyl)-3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331601
N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenoxypropanamide
CID 110325288

Frequently Asked Questions

What is the IUPAC name of 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide?
The IUPAC name of 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide (CID 110331547) is 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide.
What is the SMILES notation for 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide?
The canonical SMILES for 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide is Cc1cc(C)c2[nH]c(=O)c(CCC(=O)NC(C)c3ccccc3)cc2c1.
What is the InChIKey of 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide?
The InChIKey is VZJMUQJVXKYHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-14-11-15(2)21-19(12-14)13-18(22(26)24-21)9-10-20(25)23-16(3)17-7-5-4-6-8-17/h4-8,11-13,16H,9-10H2,1-3H3,(H,23,25)(H,24,26).
What are the key properties of 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide?
3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide has a molecular weight of 348.45 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide is sourced from PubChem (CID 110331547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).