N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide

C18H24N2O3 — CID 76543367

IUPACN-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide
SMILESCC(CCCCNC(=O)C=CC=Cc1ccccc1)C(=O)NO
InChIInChI=1S/C18H24N2O3/c1-15(18(22)20-23)9-7-8-14-19-17(21)13-6-5-12-16-10-3-2-4-11-16/h2-6,10-13,15,23H,7-9,14H2,1H3,(H,19,21)(H,20,22)
InChIKeyNKVIPERVBBCIII-UHFFFAOYSA-N
MW316.40 g/mol
LogP2.68
Rot. Bonds9

About N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide

N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide (PubChem CID 76543367) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide.

Molecular Properties

Compound NameN-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide
PubChem CID76543367
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC NameN-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide
SMILESCC(CCCCNC(=O)C=CC=Cc1ccccc1)C(=O)NO
InChIInChI=1S/C18H24N2O3/c1-15(18(22)20-23)9-7-8-14-19-17(21)13-6-5-12-16-10-3-2-4-11-16/h2-6,10-13,15,23H,7-9,14H2,1H3,(H,19,21)(H,20,22)
InChIKeyNKVIPERVBBCIII-UHFFFAOYSA-N
XLogP2.68
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 52.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide 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

N-hydroxy-5-[[(2E,4E)-5-phenylpenta-2,4-dienoyl]amino]pentanamide
CID 57495401
N-hydroxy-7-(5-phenylpenta-2,4-dienoylamino)heptanamide
CID 85068732
(2S)-3-hydroxy-2-methyl-N-[4-[[(E)-3-phenylprop-2-enoyl]amino]butyl]propanamide
CID 163193968
N-hydroxy-7-phenylhepta-2,4,6-trienamide
CID 71362968
N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide
CID 87214827
3-hydroxy-2-methylidene-N-[4-[[(E)-3-phenylprop-2-enoyl]amino]butyl]butanamide
CID 10358401
(Z)-3-phenyl-N-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl]prop-2-enamide
CID 51351606
N-[3-(dimethylamino)propyl]-3-phenylprop-2-enamide
CID 4166232
(Z)-N-[3-(dimethylamino)propyl]-3-phenylprop-2-enamide
CID 98926306
methyl (2S)-2,6-bis[[(2E,4E)-5-(3,4,5-trimethoxyphenyl)penta-2,4-dienoyl]amino]hexanoate
CID 20691749
5-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]-2-methylpentanoic acid
CID 104682529
(Z)-3-(4-propan-2-ylphenyl)-N-[4-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]butyl]prop-2-enamide
CID 92971155

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide?
The IUPAC name of N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide (CID 76543367) is N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide.
What is the SMILES notation for N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide?
The canonical SMILES for N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide is CC(CCCCNC(=O)C=CC=Cc1ccccc1)C(=O)NO.
What is the InChIKey of N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide?
The InChIKey is NKVIPERVBBCIII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-15(18(22)20-23)9-7-8-14-19-17(21)13-6-5-12-16-10-3-2-4-11-16/h2-6,10-13,15,23H,7-9,14H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide?
N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide has a molecular weight of 316.40 g/mol, XLogP of 2.68, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-methyl-6-(5-phenylpenta-2,4-dienoylamino)hexanamide is sourced from PubChem (CID 76543367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).