N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide

C19H21NO — CID 177309069

IUPACN-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide
SMILESC/C(=C\CNC(=O)c1ccccc1)CCc1ccccc1
InChIInChI=1S/C19H21NO/c1-16(12-13-17-8-4-2-5-9-17)14-15-20-19(21)18-10-6-3-7-11-18/h2-11,14H,12-13,15H2,1H3,(H,20,21)/b16-14+
InChIKeyIANZCFPNVVVVGP-JQIJEIRASA-N
MW279.38 g/mol
LogP4.00
Rot. Bonds6

About N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide

N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide (PubChem CID 177309069) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide.

Molecular Properties

Compound NameN-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide
PubChem CID177309069
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC NameN-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide
SMILESC/C(=C\CNC(=O)c1ccccc1)CCc1ccccc1
InChIInChI=1S/C19H21NO/c1-16(12-13-17-8-4-2-5-9-17)14-15-20-19(21)18-10-6-3-7-11-18/h2-11,14H,12-13,15H2,1H3,(H,20,21)/b16-14+
InChIKeyIANZCFPNVVVVGP-JQIJEIRASA-N
XLogP4.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-4-methyl-6-phenylhex-3-enoic acid
CID 129195259
(3-methyl-6-phenylhex-3-enyl)benzene
CID 175487597
N-[3-(2-phenylethylamino)prop-2-enyl]benzamide
CID 70265717
methyl (Z)-3,5-diphenylpent-2-enoate
CID 118455591
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
N-(2-sulfonylethyl)benzamide
CID 151291647
N-(2-acetamidoethyl)-4-(4-phenylbutanoylamino)benzamide
CID 121062141
methyl (E)-3-methyl-2,5-diphenylpent-2-enoate
CID 135070973
N-(2-phenylethyl)-4-(3-phenylpropanoylamino)benzamide
CID 1296529
N-[2-[3-(4-methylphenyl)propanoylamino]ethyl]benzamide
CID 24660004
(Z)-3-methyl-5-phenyl-N-prop-2-ynylpent-2-enamide
CID 75364637
N-(7-benzamido-4-oxohepta-2,5-dienyl)benzamide
CID 175163770

Frequently Asked Questions

What is the IUPAC name of N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide?
The IUPAC name of N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide (CID 177309069) is N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide.
What is the SMILES notation for N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide?
The canonical SMILES for N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide is C/C(=C\CNC(=O)c1ccccc1)CCc1ccccc1.
What is the InChIKey of N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide?
The InChIKey is IANZCFPNVVVVGP-JQIJEIRASA-N. The full InChI is InChI=1S/C19H21NO/c1-16(12-13-17-8-4-2-5-9-17)14-15-20-19(21)18-10-6-3-7-11-18/h2-11,14H,12-13,15H2,1H3,(H,20,21)/b16-14+.
What are the key properties of N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide?
N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide has a molecular weight of 279.38 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-3-methyl-5-phenylpent-2-enyl]benzamide is sourced from PubChem (CID 177309069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).