(Z)-2-chloro-3-phenylpent-2-enamide

C11H12ClNO — CID 22020272

IUPAC(Z)-2-chloro-3-phenylpent-2-enamide
SMILESCC/C(=C(/Cl)C(N)=O)c1ccccc1
InChIInChI=1S/C11H12ClNO/c1-2-9(10(12)11(13)14)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,13,14)/b10-9-
InChIKeyQQMSKVVYGQXGAZ-KTKRTIGZSA-N
MW209.68 g/mol
LogP2.53
Rot. Bonds3

About (Z)-2-chloro-3-phenylpent-2-enamide

(Z)-2-chloro-3-phenylpent-2-enamide (PubChem CID 22020272) has the molecular formula C11H12ClNO and a molecular weight of 209.68 g/mol. Its IUPAC name is (Z)-2-chloro-3-phenylpent-2-enamide.

Molecular Properties

Compound Name(Z)-2-chloro-3-phenylpent-2-enamide
PubChem CID22020272
Molecular FormulaC11H12ClNO
Molecular Weight209.68 g/mol
Exact Mass209.06
IUPAC Name(Z)-2-chloro-3-phenylpent-2-enamide
SMILESCC/C(=C(/Cl)C(N)=O)c1ccccc1
InChIInChI=1S/C11H12ClNO/c1-2-9(10(12)11(13)14)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,13,14)/b10-9-
InChIKeyQQMSKVVYGQXGAZ-KTKRTIGZSA-N
XLogP2.53
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.68
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (Z)-2-chloro-3-phenylpent-2-enamide 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

(E)-2-methyl-3-phenylpent-2-enamide
CID 66881626
4-phenylhex-3-en-3-amine
CID 140615450
(Z)-2,3-diphenylpent-2-enoic acid
CID 67236453
chloro 2-methyl-3-phenylpent-2-enoate
CID 174505232
2-acetyl-3-phenylpent-2-enoic acid
CID 150438559
ethyl (E)-2-methyl-3-phenylpent-2-enoate
CID 11310524
ethyl (Z)-2-methyl-3-phenylpent-2-enoate
CID 15743107
acetyl chloride;benzamide
CID 160666659
[(Z)-4-methylhex-3-en-3-yl]benzene
CID 142361639
1,1-diethoxybut-1-en-2-ylbenzene
CID 66973345
1-phenyl(111C)propan-1-one
CID 11159350
benzamide;ethyl carbonochloridate;hydrochloride
CID 174390729

Frequently Asked Questions

What is the IUPAC name of (Z)-2-chloro-3-phenylpent-2-enamide?
The IUPAC name of (Z)-2-chloro-3-phenylpent-2-enamide (CID 22020272) is (Z)-2-chloro-3-phenylpent-2-enamide.
What is the SMILES notation for (Z)-2-chloro-3-phenylpent-2-enamide?
The canonical SMILES for (Z)-2-chloro-3-phenylpent-2-enamide is CC/C(=C(/Cl)C(N)=O)c1ccccc1.
What is the InChIKey of (Z)-2-chloro-3-phenylpent-2-enamide?
The InChIKey is QQMSKVVYGQXGAZ-KTKRTIGZSA-N. The full InChI is InChI=1S/C11H12ClNO/c1-2-9(10(12)11(13)14)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,13,14)/b10-9-.
What are the key properties of (Z)-2-chloro-3-phenylpent-2-enamide?
(Z)-2-chloro-3-phenylpent-2-enamide has a molecular weight of 209.68 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-chloro-3-phenylpent-2-enamide is sourced from PubChem (CID 22020272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).