(Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide

C16H14ClNO2 — CID 56971501

IUPAC(Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide
SMILESCO/C(=C\c1ccccc1)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H14ClNO2/c1-20-15(11-12-5-3-2-4-6-12)16(19)18-14-9-7-13(17)8-10-14/h2-11H,1H3,(H,18,19)/b15-11-
InChIKeyVJHJKFAKTFTOSL-PTNGSMBKSA-N
MW287.75 g/mol
LogP3.97
Rot. Bonds4

About (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide

(Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide (PubChem CID 56971501) has the molecular formula C16H14ClNO2 and a molecular weight of 287.75 g/mol. Its IUPAC name is (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide.

Molecular Properties

Compound Name(Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide
PubChem CID56971501
Molecular FormulaC16H14ClNO2
Molecular Weight287.75 g/mol
Exact Mass287.07
IUPAC Name(Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide
SMILESCO/C(=C\c1ccccc1)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H14ClNO2/c1-20-15(11-12-5-3-2-4-6-12)16(19)18-14-9-7-13(17)8-10-14/h2-11H,1H3,(H,18,19)/b15-11-
InChIKeyVJHJKFAKTFTOSL-PTNGSMBKSA-N
XLogP3.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N1-phenyl-3-(2-chlorophenyl)acrylamide
CID 737170
6-Chloro-3-hydroxyquinolin-2(1H)-one
CID 20431233
(2E)-N-(3-chlorophenyl)-3-phenylprop-2-enamide
CID 677915
2-Propenamide, N-(4-chlorophenyl)-3-phenyl-
CID 766168
N-(5-chloro-2-methylphenyl)-2-methoxyacetamide
CID 795634
2(1H)-Quinolinone, 3-methoxy-
CID 820270
N-[4-(acetylamino)phenyl]-3-(4-chlorophenyl)acrylamide
CID 1122474
3-Methoxy-4-phenyl-1H-quinolin-2-one
CID 477707
N-(3-chloro-2-methylphenyl)-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 18170180
N-(3-chloro-4-methylphenyl)-2-methoxyacetamide
CID 836498
(2-anilino-2-oxoethyl) (E)-3-(4-chlorophenyl)prop-2-enoate
CID 2343081
(2E,4E)-N-(3-chlorophenyl)-5-phenylpenta-2,4-dienamide
CID 56640991

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide?
The IUPAC name of (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide (CID 56971501) is (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide.
What is the SMILES notation for (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide?
The canonical SMILES for (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide is CO/C(=C\c1ccccc1)C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide?
The InChIKey is VJHJKFAKTFTOSL-PTNGSMBKSA-N. The full InChI is InChI=1S/C16H14ClNO2/c1-20-15(11-12-5-3-2-4-6-12)16(19)18-14-9-7-13(17)8-10-14/h2-11H,1H3,(H,18,19)/b15-11-.
What are the key properties of (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide?
(Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide has a molecular weight of 287.75 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(4-chlorophenyl)-2-methoxy-3-phenylprop-2-enamide is sourced from PubChem (CID 56971501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).