4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide

C19H28N2O3 — CID 58417470

IUPAC4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide
SMILESCC(C)(C)C(NC(=O)C1CCCCC1)c1ccc(C(=O)NO)cc1
InChIInChI=1S/C19H28N2O3/c1-19(2,3)16(20-17(22)14-7-5-4-6-8-14)13-9-11-15(12-10-13)18(23)21-24/h9-12,14,16,24H,4-8H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyHGYMBZKLHWCOMK-UHFFFAOYSA-N
MW332.44 g/mol
LogP3.59
Rot. Bonds4

About 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide

4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide (PubChem CID 58417470) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide.

Molecular Properties

Compound Name4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide
PubChem CID58417470
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC Name4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide
SMILESCC(C)(C)C(NC(=O)C1CCCCC1)c1ccc(C(=O)NO)cc1
InChIInChI=1S/C19H28N2O3/c1-19(2,3)16(20-17(22)14-7-5-4-6-8-14)13-9-11-15(12-10-13)18(23)21-24/h9-12,14,16,24H,4-8H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyHGYMBZKLHWCOMK-UHFFFAOYSA-N
XLogP3.59
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 53.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide?
The IUPAC name of 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide (CID 58417470) is 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide.
What is the SMILES notation for 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide?
The canonical SMILES for 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide is CC(C)(C)C(NC(=O)C1CCCCC1)c1ccc(C(=O)NO)cc1.
What is the InChIKey of 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide?
The InChIKey is HGYMBZKLHWCOMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-19(2,3)16(20-17(22)14-7-5-4-6-8-14)13-9-11-15(12-10-13)18(23)21-24/h9-12,14,16,24H,4-8H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide?
4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide has a molecular weight of 332.44 g/mol, XLogP of 3.59, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(cyclohexanecarbonylamino)-2,2-dimethylpropyl]-N-hydroxybenzamide is sourced from PubChem (CID 58417470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).