N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide

C16H22N2O2 — CID 47212500

IUPACN-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)N(CC(N)=O)C2CCCC2)c1
InChIInChI=1S/C16H22N2O2/c1-11-7-12(2)9-13(8-11)16(20)18(10-15(17)19)14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3,(H2,17,19)
InChIKeyVUZYVJOKVUAUFX-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.17
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide

N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide (PubChem CID 47212500) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide
PubChem CID47212500
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)N(CC(N)=O)C2CCCC2)c1
InChIInChI=1S/C16H22N2O2/c1-11-7-12(2)9-13(8-11)16(20)18(10-15(17)19)14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3,(H2,17,19)
InChIKeyVUZYVJOKVUAUFX-UHFFFAOYSA-N
XLogP2.17
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminoethyl)-N-cyclopentyl-3,5-dimethylbenzamide
CID 63755882
N-cyclopentyl-N-(2-hydroxyethyl)-3,5-dimethylbenzamide
CID 54993921
N-(2-chloroethyl)-N-cyclobutyl-3,5-dimethylbenzamide
CID 102872881
N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-iodobenzamide
CID 47212490
N-(2-amino-2-oxoethyl)-5-bromo-N-cyclopentyl-3-methylfuran-2-carboxamide
CID 47352466
N-(2-amino-2-oxoethyl)-N-cyclopentyl-1H-indole-6-carboxamide
CID 61217148
3-bromo-N-cyclopentyl-N-(2-hydroxyethyl)-5-methylbenzamide
CID 104852405
3-chloro-N-(2-chloroethyl)-N-cyclohexyl-5-methylbenzamide
CID 81324250
5-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-2-fluorobenzamide
CID 61110216
N-(2-bromoethyl)-N-cyclobutyl-3-fluoro-5-methylbenzamide
CID 102873053
N-[(2Z)-2-amino-2-hydroxyiminoethyl]-N-cyclopentyl-2-methylpyridine-4-carboxamide
CID 106753961
N-(2-amino-2-oxoethyl)-1-tert-butyl-N-cyclopentyl-5-cyclopropylpyrazole-3-carboxamide
CID 56817946

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide (CID 47212500) is N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide is Cc1cc(C)cc(C(=O)N(CC(N)=O)C2CCCC2)c1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide?
The InChIKey is VUZYVJOKVUAUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-11-7-12(2)9-13(8-11)16(20)18(10-15(17)19)14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3,(H2,17,19).
What are the key properties of N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide?
N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide has a molecular weight of 274.36 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide is sourced from PubChem (CID 47212500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).