O-(4-methylcyclohexen-1-yl)hydroxylamine

C7H13NO — CID 67709235

IUPACO-(4-methylcyclohexen-1-yl)hydroxylamine
SMILESCC1CC=C(ON)CC1
InChIInChI=1S/C7H13NO/c1-6-2-4-7(9-8)5-3-6/h4,6H,2-3,5,8H2,1H3
InChIKeyKYAPPPISSCVUJC-UHFFFAOYSA-N
MW127.19 g/mol
LogP1.58
Rot. Bonds1

About O-(4-methylcyclohexen-1-yl)hydroxylamine

O-(4-methylcyclohexen-1-yl)hydroxylamine (PubChem CID 67709235) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is O-(4-methylcyclohexen-1-yl)hydroxylamine.

Molecular Properties

Compound NameO-(4-methylcyclohexen-1-yl)hydroxylamine
PubChem CID67709235
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC NameO-(4-methylcyclohexen-1-yl)hydroxylamine
SMILESCC1CC=C(ON)CC1
InChIInChI=1S/C7H13NO/c1-6-2-4-7(9-8)5-3-6/h4,6H,2-3,5,8H2,1H3
InChIKeyKYAPPPISSCVUJC-UHFFFAOYSA-N
XLogP1.58
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze O-(4-methylcyclohexen-1-yl)hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of O-(4-methylcyclohexen-1-yl)hydroxylamine?
The IUPAC name of O-(4-methylcyclohexen-1-yl)hydroxylamine (CID 67709235) is O-(4-methylcyclohexen-1-yl)hydroxylamine.
What is the SMILES notation for O-(4-methylcyclohexen-1-yl)hydroxylamine?
The canonical SMILES for O-(4-methylcyclohexen-1-yl)hydroxylamine is CC1CC=C(ON)CC1.
What is the InChIKey of O-(4-methylcyclohexen-1-yl)hydroxylamine?
The InChIKey is KYAPPPISSCVUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-6-2-4-7(9-8)5-3-6/h4,6H,2-3,5,8H2,1H3.
What are the key properties of O-(4-methylcyclohexen-1-yl)hydroxylamine?
O-(4-methylcyclohexen-1-yl)hydroxylamine has a molecular weight of 127.19 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-(4-methylcyclohexen-1-yl)hydroxylamine is sourced from PubChem (CID 67709235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).