N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide

C13H13NO — CID 12826863

IUPACN-cyclopenta-2,4-dien-1-yl-N-phenylacetamide
SMILESCC(=O)N(c1ccccc1)C1C=CC=C1
InChIInChI=1S/C13H13NO/c1-11(15)14(13-9-5-6-10-13)12-7-3-2-4-8-12/h2-10,13H,1H3
InChIKeyIBBGDDYBWSGERG-UHFFFAOYSA-N
MW199.25 g/mol
LogP2.53
Rot. Bonds2

About N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide

N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide (PubChem CID 12826863) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide.

Molecular Properties

Compound NameN-cyclopenta-2,4-dien-1-yl-N-phenylacetamide
PubChem CID12826863
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC NameN-cyclopenta-2,4-dien-1-yl-N-phenylacetamide
SMILESCC(=O)N(c1ccccc1)C1C=CC=C1
InChIInChI=1S/C13H13NO/c1-11(15)14(13-9-5-6-10-13)12-7-3-2-4-8-12/h2-10,13H,1H3
InChIKeyIBBGDDYBWSGERG-UHFFFAOYSA-N
XLogP2.53
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-methylpiperidin-4-yl)-N-phenylacetamide
CID 527022
N-[4-(N-acetylanilino)phenyl]-N-phenylacetamide
CID 14470893
N-phenyl-N-piperidin-2-ylacetamide
CID 173183713
N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 915645
N-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 3756805
N-acetyl-2,2-difluoro-N-phenylacetamide
CID 175560848
N-acetyl-3-oxo-N-phenylbutanamide
CID 88604895
2-amino-N-phenylacetohydrazide
CID 70067236
N-[(2R,4R)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl]-N-phenylacetamide
CID 687228
N-((1,2,3,4,5,6-13C6)cyclohexatrienyl)-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
CID 165365115
N-[(2S,4R)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl]-N-phenylacetamide
CID 687227
N'-acetyl-N'-(4-hydroxyphenyl)-N-phenylacetohydrazide
CID 141032326

Frequently Asked Questions

What is the IUPAC name of N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide?
The IUPAC name of N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide (CID 12826863) is N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide.
What is the SMILES notation for N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide?
The canonical SMILES for N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide is CC(=O)N(c1ccccc1)C1C=CC=C1.
What is the InChIKey of N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide?
The InChIKey is IBBGDDYBWSGERG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO/c1-11(15)14(13-9-5-6-10-13)12-7-3-2-4-8-12/h2-10,13H,1H3.
What are the key properties of N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide?
N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide has a molecular weight of 199.25 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopenta-2,4-dien-1-yl-N-phenylacetamide is sourced from PubChem (CID 12826863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).