3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide

C24H26N2O3 — CID 110413285

IUPAC3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
SMILESCOc1ccc(C(CC(=O)NCc2cc3ccccc3[nH]c2=O)C2CC2)cc1C
InChIInChI=1S/C24H26N2O3/c1-15-11-17(9-10-22(15)29-2)20(16-7-8-16)13-23(27)25-14-19-12-18-5-3-4-6-21(18)26-24(19)28/h3-6,9-12,16,20H,7-8,13-14H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyTVFWFWHNEFTSRN-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.05
Rot. Bonds7

About 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide

3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide (PubChem CID 110413285) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide.

Molecular Properties

Compound Name3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
PubChem CID110413285
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC Name3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
SMILESCOc1ccc(C(CC(=O)NCc2cc3ccccc3[nH]c2=O)C2CC2)cc1C
InChIInChI=1S/C24H26N2O3/c1-15-11-17(9-10-22(15)29-2)20(16-7-8-16)13-23(27)25-14-19-12-18-5-3-4-6-21(18)26-24(19)28/h3-6,9-12,16,20H,7-8,13-14H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyTVFWFWHNEFTSRN-UHFFFAOYSA-N
XLogP4.05
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopropyl-3-(4-methoxyphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 110616654
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(4-methoxyphenyl)methyl]propanamide
CID 110297458
3-cyclopropyl-N-(2-hydroxy-2-methylpropyl)-3-(4-methoxy-3-methylphenyl)propanamide
CID 110306820
3-(4-fluorophenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide
CID 110619584
3-cyclopropyl-N-[2-(diethylamino)propyl]-3-(4-methoxy-3-methylphenyl)propanamide
CID 110301496
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-(2-oxo-2-piperidin-1-ylethyl)propanamide
CID 110312177
2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616683
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
CID 110310845
2-(4-methoxyphenyl)-3-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide
CID 110619593
3-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)propanamide
CID 110407527
2-(2-methoxyphenoxy)-N-[(2-oxo-6-propan-2-yl-1H-quinolin-3-yl)methyl]acetamide
CID 110325585
2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616680

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide?
The IUPAC name of 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide (CID 110413285) is 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide.
What is the SMILES notation for 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide?
The canonical SMILES for 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide is COc1ccc(C(CC(=O)NCc2cc3ccccc3[nH]c2=O)C2CC2)cc1C.
What is the InChIKey of 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide?
The InChIKey is TVFWFWHNEFTSRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-15-11-17(9-10-22(15)29-2)20(16-7-8-16)13-23(27)25-14-19-12-18-5-3-4-6-21(18)26-24(19)28/h3-6,9-12,16,20H,7-8,13-14H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide?
3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide has a molecular weight of 390.48 g/mol, XLogP of 4.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide is sourced from PubChem (CID 110413285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).