N-hydroxycyclohexanecarboxamide;hydrochloride

C7H14ClNO2 — CID 174569477

IUPACN-hydroxycyclohexanecarboxamide;hydrochloride
SMILESCl.O=C(NO)C1CCCCC1
InChIInChI=1S/C7H13NO2.ClH/c9-7(8-10)6-4-2-1-3-5-6;/h6,10H,1-5H2,(H,8,9);1H
InChIKeyUETBVMKVTPLPRA-UHFFFAOYSA-N
MW179.65 g/mol
LogP1.49
Rot. Bonds1

About N-hydroxycyclohexanecarboxamide;hydrochloride

N-hydroxycyclohexanecarboxamide;hydrochloride (PubChem CID 174569477) has the molecular formula C7H14ClNO2 and a molecular weight of 179.65 g/mol. Its IUPAC name is N-hydroxycyclohexanecarboxamide;hydrochloride.

Molecular Properties

Compound NameN-hydroxycyclohexanecarboxamide;hydrochloride
PubChem CID174569477
Molecular FormulaC7H14ClNO2
Molecular Weight179.65 g/mol
Exact Mass179.07
IUPAC NameN-hydroxycyclohexanecarboxamide;hydrochloride
SMILESCl.O=C(NO)C1CCCCC1
InChIInChI=1S/C7H13NO2.ClH/c9-7(8-10)6-4-2-1-3-5-6;/h6,10H,1-5H2,(H,8,9);1H
InChIKeyUETBVMKVTPLPRA-UHFFFAOYSA-N
XLogP1.49
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.65
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-hydroxycyclohexanecarboxamide;hydrochloride 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'-hydroxycyclohexanecarbohydrazide
CID 151692012
N-[2-(cyclooctanecarbonylamino)cyclohexyl]cyclooctanecarboxamide
CID 171722262
N-cyclopropylcycloheptanecarboxamide
CID 62778853
N-cycloheptylcycloheptanecarboxamide
CID 129091005
N-cyclodecylcyclododecanecarboxamide
CID 135182352
N-cyclopropylcyclohexanecarboxamide
CID 3412875
molecular hydrogen;N-propan-2-ylcyclohexanecarboxamide
CID 165395427
N-[cyclohexyl(hydroxy)methyl]cyclohexanecarboxamide
CID 101432144
N-propylcyclohexanecarboxamide;hydrochloride
CID 174790388
cyclohexanecarboxylic acid;trihydrochloride
CID 67185988
ethane;N-hydroxy-4-propan-2-ylcyclohexane-1-carboxamide
CID 167456902
N-hydroxy-1-iodopiperidine-4-carboxamide
CID 146665730

Frequently Asked Questions

What is the IUPAC name of N-hydroxycyclohexanecarboxamide;hydrochloride?
The IUPAC name of N-hydroxycyclohexanecarboxamide;hydrochloride (CID 174569477) is N-hydroxycyclohexanecarboxamide;hydrochloride.
What is the SMILES notation for N-hydroxycyclohexanecarboxamide;hydrochloride?
The canonical SMILES for N-hydroxycyclohexanecarboxamide;hydrochloride is Cl.O=C(NO)C1CCCCC1.
What is the InChIKey of N-hydroxycyclohexanecarboxamide;hydrochloride?
The InChIKey is UETBVMKVTPLPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2.ClH/c9-7(8-10)6-4-2-1-3-5-6;/h6,10H,1-5H2,(H,8,9);1H.
What are the key properties of N-hydroxycyclohexanecarboxamide;hydrochloride?
N-hydroxycyclohexanecarboxamide;hydrochloride has a molecular weight of 179.65 g/mol, XLogP of 1.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxycyclohexanecarboxamide;hydrochloride is sourced from PubChem (CID 174569477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).