2-(4-acetylanilino)-N-methylpropanamide

C12H16N2O2 — CID 115573414

IUPAC2-(4-acetylanilino)-N-methylpropanamide
SMILESCNC(=O)C(C)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C12H16N2O2/c1-8(12(16)13-3)14-11-6-4-10(5-7-11)9(2)15/h4-8,14H,1-3H3,(H,13,16)
InChIKeyDFKCPMSWZLARSY-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.44
Rot. Bonds4

About 2-(4-acetylanilino)-N-methylpropanamide

2-(4-acetylanilino)-N-methylpropanamide (PubChem CID 115573414) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-(4-acetylanilino)-N-methylpropanamide.

Molecular Properties

Compound Name2-(4-acetylanilino)-N-methylpropanamide
PubChem CID115573414
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-(4-acetylanilino)-N-methylpropanamide
SMILESCNC(=O)C(C)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C12H16N2O2/c1-8(12(16)13-3)14-11-6-4-10(5-7-11)9(2)15/h4-8,14H,1-3H3,(H,13,16)
InChIKeyDFKCPMSWZLARSY-UHFFFAOYSA-N
XLogP1.44
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-carbamothioylanilino)-N-methylpropanamide
CID 61467405
(2S)-N-(4-acetylphenyl)-2-(4-chloroanilino)propanamide
CID 8019529
(2R)-N-(4-acetylphenyl)-2-(4-chloroanilino)propanamide
CID 8019533
2-(4-iodoanilino)-N-methylpropanamide
CID 43086006
2-(4-tert-butylanilino)-N-methylpropanamide
CID 43085951
ethyl 2-(4-acetylanilino)propanoate
CID 62004850
1-[4-[(1-hydroxy-2-methylpropyl)amino]phenyl]ethanone
CID 142294720
4-[[(2R)-1-(4-acetylanilino)-1-oxopropan-2-yl]amino]-N,N-diethylbenzamide
CID 9326771
2-(4-acetylanilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
CID 42917950
1-[4-(but-3-en-2-ylamino)phenyl]ethanone
CID 114468469
2-(4-acetylanilino)-1-piperidin-1-ylpropan-1-one
CID 115571713
N-methyl-2-(4-phenoxyanilino)propanamide
CID 43085961

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylanilino)-N-methylpropanamide?
The IUPAC name of 2-(4-acetylanilino)-N-methylpropanamide (CID 115573414) is 2-(4-acetylanilino)-N-methylpropanamide.
What is the SMILES notation for 2-(4-acetylanilino)-N-methylpropanamide?
The canonical SMILES for 2-(4-acetylanilino)-N-methylpropanamide is CNC(=O)C(C)Nc1ccc(C(C)=O)cc1.
What is the InChIKey of 2-(4-acetylanilino)-N-methylpropanamide?
The InChIKey is DFKCPMSWZLARSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-8(12(16)13-3)14-11-6-4-10(5-7-11)9(2)15/h4-8,14H,1-3H3,(H,13,16).
What are the key properties of 2-(4-acetylanilino)-N-methylpropanamide?
2-(4-acetylanilino)-N-methylpropanamide has a molecular weight of 220.27 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylanilino)-N-methylpropanamide is sourced from PubChem (CID 115573414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).