N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide

C15H20N2O3 — CID 87214827

IUPACN-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide
SMILESO=C(/C=C\c1ccccc1)NCCCCCC(=O)NO
InChIInChI=1S/C15H20N2O3/c18-14(11-10-13-7-3-1-4-8-13)16-12-6-2-5-9-15(19)17-20/h1,3-4,7-8,10-11,20H,2,5-6,9,12H2,(H,16,18)(H,17,19)/b11-10-
InChIKeyNRWALYHECPWEAM-KHPPLWFESA-N
MW276.34 g/mol
LogP1.88
Rot. Bonds8

About N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide

N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide (PubChem CID 87214827) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide.

Molecular Properties

Compound NameN-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide
PubChem CID87214827
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide
SMILESO=C(/C=C\c1ccccc1)NCCCCCC(=O)NO
InChIInChI=1S/C15H20N2O3/c18-14(11-10-13-7-3-1-4-8-13)16-12-6-2-5-9-15(19)17-20/h1,3-4,7-8,10-11,20H,2,5-6,9,12H2,(H,16,18)(H,17,19)/b11-10-
InChIKeyNRWALYHECPWEAM-KHPPLWFESA-N
XLogP1.88
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.88
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'}

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Related Compounds

N-hydroxy-7-(5-phenylpenta-2,4-dienoylamino)heptanamide
CID 85068732
N-hydroxy-5-[[(2E,4E)-5-phenylpenta-2,4-dienoyl]amino]pentanamide
CID 57495401
(Z)-3-phenyl-N-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl]prop-2-enamide
CID 51351606
6-[[(E)-3-(3-methylphenyl)prop-2-enoyl]amino]hexanoic acid
CID 43238449
N-[3-(dimethylamino)propyl]-3-phenylprop-2-enamide
CID 4166232
(Z)-N-[3-(dimethylamino)propyl]-3-phenylprop-2-enamide
CID 98926306
(2S)-3-hydroxy-2-methyl-N-[4-[[(E)-3-phenylprop-2-enoyl]amino]butyl]propanamide
CID 163193968
7-(3-pyridin-3-ylprop-2-enoylamino)heptanoic acid
CID 74872321
N-hydroxy-6-(5-naphthalen-1-ylpenta-2,4-dienoylamino)hexanamide
CID 85325370
3-phenyl-N-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl]propanamide
CID 108573771
3-(4-fluorophenyl)-N-[8-[3-(4-fluorophenyl)prop-2-enoylamino]octyl]prop-2-enamide
CID 5142775
N-[2-(methylamino)ethyl]-3-phenylprop-2-enamide
CID 76948085

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide?
The IUPAC name of N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide (CID 87214827) is N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide.
What is the SMILES notation for N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide?
The canonical SMILES for N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide is O=C(/C=C\c1ccccc1)NCCCCCC(=O)NO.
What is the InChIKey of N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide?
The InChIKey is NRWALYHECPWEAM-KHPPLWFESA-N. The full InChI is InChI=1S/C15H20N2O3/c18-14(11-10-13-7-3-1-4-8-13)16-12-6-2-5-9-15(19)17-20/h1,3-4,7-8,10-11,20H,2,5-6,9,12H2,(H,16,18)(H,17,19)/b11-10-.
What are the key properties of N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide?
N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide has a molecular weight of 276.34 g/mol, XLogP of 1.88, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-6-[[(Z)-3-phenylprop-2-enoyl]amino]hexanamide is sourced from PubChem (CID 87214827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).