N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide

C16H22N2O2 — CID 113058076

IUPACN-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide
SMILESCC(=O)N(CCNC(=O)C1CC1)c1c(C)cccc1C
InChIInChI=1S/C16H22N2O2/c1-11-5-4-6-12(2)15(11)18(13(3)19)10-9-17-16(20)14-7-8-14/h4-6,14H,7-10H2,1-3H3,(H,17,20)
InChIKeySRYSVAZSQQILFK-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.18
Rot. Bonds5

About N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide

N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide (PubChem CID 113058076) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide
PubChem CID113058076
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide
SMILESCC(=O)N(CCNC(=O)C1CC1)c1c(C)cccc1C
InChIInChI=1S/C16H22N2O2/c1-11-5-4-6-12(2)15(11)18(13(3)19)10-9-17-16(20)14-7-8-14/h4-6,14H,7-10H2,1-3H3,(H,17,20)
InChIKeySRYSVAZSQQILFK-UHFFFAOYSA-N
XLogP2.18
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide
CID 113058073
N-[2-(N-acetyl-2,6-difluoroanilino)ethyl]oxane-4-carboxamide
CID 113064554
N-[2-(N-acetyl-2-chloro-4,6-dimethylanilino)ethyl]oxane-4-carboxamide
CID 113060185
N-[2-(N,3-diacetylanilino)ethyl]cyclobutanecarboxamide
CID 113061599
N-[2-(N-acetyl-3-chloroanilino)ethyl]cyclobutanecarboxamide
CID 113059565
N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide
CID 113058289
N-[2-(N,4-diacetylanilino)ethyl]cyclobutanecarboxamide
CID 113061690
N-[2-(N-acetyl-2-bromoanilino)ethyl]cyclohexanecarboxamide
CID 113062722
N-[2-[(2,6-dimethylphenyl)methylamino]ethyl]cyclopropanecarboxamide
CID 115641192
N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]-3-phenoxypropanamide
CID 113058113
N-[2-(N-acetyl-2,3-dimethylanilino)ethyl]oxolane-2-carboxamide
CID 113058185
N-[2-(N-acetyl-4-tert-butylanilino)ethyl]cyclohexanecarboxamide
CID 113059086

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide (CID 113058076) is N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide is CC(=O)N(CCNC(=O)C1CC1)c1c(C)cccc1C.
What is the InChIKey of N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide?
The InChIKey is SRYSVAZSQQILFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-11-5-4-6-12(2)15(11)18(13(3)19)10-9-17-16(20)14-7-8-14/h4-6,14H,7-10H2,1-3H3,(H,17,20).
What are the key properties of N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide?
N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide has a molecular weight of 274.36 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 113058076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).