(E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide

C22H22N2O3 — CID 75421720

IUPAC(E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide
SMILESO=C(CC/C=C/c1ccccc1)Nc1ccc(N2C(=O)CCCC2=O)cc1
InChIInChI=1S/C22H22N2O3/c25-20(10-5-4-9-17-7-2-1-3-8-17)23-18-13-15-19(16-14-18)24-21(26)11-6-12-22(24)27/h1-4,7-9,13-16H,5-6,10-12H2,(H,23,25)/b9-4+
InChIKeyPSZVTDNHEWPSDQ-RUDMXATFSA-N
MW362.43 g/mol
LogP4.16
Rot. Bonds6

About (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide

(E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide (PubChem CID 75421720) has the molecular formula C22H22N2O3 and a molecular weight of 362.43 g/mol. Its IUPAC name is (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide.

Molecular Properties

Compound Name(E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide
PubChem CID75421720
Molecular FormulaC22H22N2O3
Molecular Weight362.43 g/mol
Exact Mass362.16
IUPAC Name(E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide
SMILESO=C(CC/C=C/c1ccccc1)Nc1ccc(N2C(=O)CCCC2=O)cc1
InChIInChI=1S/C22H22N2O3/c25-20(10-5-4-9-17-7-2-1-3-8-17)23-18-13-15-19(16-14-18)24-21(26)11-6-12-22(24)27/h1-4,7-9,13-16H,5-6,10-12H2,(H,23,25)/b9-4+
InChIKeyPSZVTDNHEWPSDQ-RUDMXATFSA-N
XLogP4.16
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(benzimidazol-1-yl)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]propanamide
CID 60553645
(E)-N-[4-(chloromethyl)phenyl]-7-phenylhept-6-enamide
CID 174957132
(E)-N-[3-(hydroxymethyl)phenyl]-5-phenylpent-4-enamide
CID 111437309
N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
CID 51115082
N-[4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]phenyl]pentanamide
CID 112984571
N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(2-phenylethyl)benzamide
CID 60553477
N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2,5-dimethyl-1-phenylpyrrole-3-carboxamide
CID 60553560
2-[1-[[(E)-5-phenylpent-4-enoyl]amino]cyclobutyl]acetic acid
CID 119217364
1-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(4-phenoxyphenyl)thiourea
CID 43076285
(E)-5-phenylpent-4-enoic acid
CID 5370650
3-[benzyl(methyl)amino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 17397146
(2R)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 94801265

Frequently Asked Questions

What is the IUPAC name of (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide?
The IUPAC name of (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide (CID 75421720) is (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide.
What is the SMILES notation for (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide?
The canonical SMILES for (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide is O=C(CC/C=C/c1ccccc1)Nc1ccc(N2C(=O)CCCC2=O)cc1.
What is the InChIKey of (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide?
The InChIKey is PSZVTDNHEWPSDQ-RUDMXATFSA-N. The full InChI is InChI=1S/C22H22N2O3/c25-20(10-5-4-9-17-7-2-1-3-8-17)23-18-13-15-19(16-14-18)24-21(26)11-6-12-22(24)27/h1-4,7-9,13-16H,5-6,10-12H2,(H,23,25)/b9-4+.
What are the key properties of (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide?
(E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide has a molecular weight of 362.43 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide is sourced from PubChem (CID 75421720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).