N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide

C16H23N3O2 — CID 60944498

IUPACN-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide
SMILESCN(CC(=O)Nc1ccccc1)C(=O)CNC1CCCC1
InChIInChI=1S/C16H23N3O2/c1-19(16(21)11-17-13-7-5-6-8-13)12-15(20)18-14-9-3-2-4-10-14/h2-4,9-10,13,17H,5-8,11-12H2,1H3,(H,18,20)
InChIKeySJYSUFSOYZZODV-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.62
Rot. Bonds6

About N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide

N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide (PubChem CID 60944498) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide
PubChem CID60944498
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide
SMILESCN(CC(=O)Nc1ccccc1)C(=O)CNC1CCCC1
InChIInChI=1S/C16H23N3O2/c1-19(16(21)11-17-13-7-5-6-8-13)12-15(20)18-14-9-3-2-4-10-14/h2-4,9-10,13,17H,5-8,11-12H2,1H3,(H,18,20)
InChIKeySJYSUFSOYZZODV-UHFFFAOYSA-N
XLogP1.62
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide?
The IUPAC name of N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide (CID 60944498) is N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide.
What is the SMILES notation for N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide?
The canonical SMILES for N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide is CN(CC(=O)Nc1ccccc1)C(=O)CNC1CCCC1.
What is the InChIKey of N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide?
The InChIKey is SJYSUFSOYZZODV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-19(16(21)11-17-13-7-5-6-8-13)12-15(20)18-14-9-3-2-4-10-14/h2-4,9-10,13,17H,5-8,11-12H2,1H3,(H,18,20).
What are the key properties of N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide?
N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide has a molecular weight of 289.38 g/mol, XLogP of 1.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide is sourced from PubChem (CID 60944498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).