N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide

C20H26N2O2 — CID 100744084

IUPACN-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide
SMILESCc1cc(C)c2c(=O)ccn(CC(=O)NC3CCCCCC3)c2c1
InChIInChI=1S/C20H26N2O2/c1-14-11-15(2)20-17(12-14)22(10-9-18(20)23)13-19(24)21-16-7-5-3-4-6-8-16/h9-12,16H,3-8,13H2,1-2H3,(H,21,24)
InChIKeyRCTBZTZEDXHHEM-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.46
Rot. Bonds3

About N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide

N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide (PubChem CID 100744084) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide
PubChem CID100744084
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide
SMILESCc1cc(C)c2c(=O)ccn(CC(=O)NC3CCCCCC3)c2c1
InChIInChI=1S/C20H26N2O2/c1-14-11-15(2)20-17(12-14)22(10-9-18(20)23)13-19(24)21-16-7-5-3-4-6-8-16/h9-12,16H,3-8,13H2,1-2H3,(H,21,24)
InChIKeyRCTBZTZEDXHHEM-UHFFFAOYSA-N
XLogP3.46
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide
CID 100744049
2-(5,7-dimethyl-4-oxoquinolin-1-yl)-N-(4-fluorophenyl)acetamide
CID 100744381
2-(6-bromo-4-oxoquinolin-1-yl)-N-cyclooctylacetamide
CID 100737684
N-(1,3-benzodioxol-5-yl)-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide
CID 100744676
2-(6-chloroindol-1-yl)-N-cyclohexylacetamide
CID 115590568
1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5,7-dimethylquinolin-4-one
CID 100745064
N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
CID 91639863
N-cyclohexyl-2-(2-oxo-3-propylimidazol-1-yl)acetamide
CID 116624888
2-(6-chloroindol-1-yl)-N-cyclopentylacetamide
CID 39339466
1-[2-(cyclopentylamino)-2-oxoethyl]indole-5-carboxylic acid
CID 63748060
N-cyclopentyl-2-(5-propan-2-ylindol-1-yl)acetamide
CID 110831029
N-cyclohexyl-2-(4,6,8-trimethyl-2-oxoquinolin-1-yl)acetamide
CID 39768332

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide (CID 100744084) is N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide is Cc1cc(C)c2c(=O)ccn(CC(=O)NC3CCCCCC3)c2c1.
What is the InChIKey of N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide?
The InChIKey is RCTBZTZEDXHHEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-14-11-15(2)20-17(12-14)22(10-9-18(20)23)13-19(24)21-16-7-5-3-4-6-8-16/h9-12,16H,3-8,13H2,1-2H3,(H,21,24).
What are the key properties of N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide?
N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide has a molecular weight of 326.44 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 100744084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).