3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide

C19H26N2O2 — CID 75361156

IUPAC3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide
SMILESCC1(C)CC(=O)Nc2ccc(NC(=O)CCC3CCCC3)cc21
InChIInChI=1S/C19H26N2O2/c1-19(2)12-18(23)21-16-9-8-14(11-15(16)19)20-17(22)10-7-13-5-3-4-6-13/h8-9,11,13H,3-7,10,12H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyOVLGTGDODBCKHK-UHFFFAOYSA-N
MW314.43 g/mol
LogP4.22
Rot. Bonds4

About 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide

3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide (PubChem CID 75361156) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide
PubChem CID75361156
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC Name3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide
SMILESCC1(C)CC(=O)Nc2ccc(NC(=O)CCC3CCCC3)cc21
InChIInChI=1S/C19H26N2O2/c1-19(2)12-18(23)21-16-9-8-14(11-15(16)19)20-17(22)10-7-13-5-3-4-6-13/h8-9,11,13H,3-7,10,12H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyOVLGTGDODBCKHK-UHFFFAOYSA-N
XLogP4.22
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide?
The IUPAC name of 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide (CID 75361156) is 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide is CC1(C)CC(=O)Nc2ccc(NC(=O)CCC3CCCC3)cc21.
What is the InChIKey of 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide?
The InChIKey is OVLGTGDODBCKHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c1-19(2)12-18(23)21-16-9-8-14(11-15(16)19)20-17(22)10-7-13-5-3-4-6-13/h8-9,11,13H,3-7,10,12H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide?
3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide has a molecular weight of 314.43 g/mol, XLogP of 4.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide is sourced from PubChem (CID 75361156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).