N-cyclohexylidenehydroxylamine;propan-2-ol

C9H19NO2 — CID 175240133

IUPACN-cyclohexylidenehydroxylamine;propan-2-ol
SMILESCC(C)O.ON=C1CCCCC1
InChIInChI=1S/C6H11NO.C3H8O/c8-7-6-4-2-1-3-5-6;1-3(2)4/h8H,1-5H2;3-4H,1-2H3
InChIKeyDCTDAOGVGQHNJW-UHFFFAOYSA-N
MW173.26 g/mol
LogP2.17
Rot. Bonds

About N-cyclohexylidenehydroxylamine;propan-2-ol

N-cyclohexylidenehydroxylamine;propan-2-ol (PubChem CID 175240133) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-cyclohexylidenehydroxylamine;propan-2-ol.

Molecular Properties

Compound NameN-cyclohexylidenehydroxylamine;propan-2-ol
PubChem CID175240133
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-cyclohexylidenehydroxylamine;propan-2-ol
SMILESCC(C)O.ON=C1CCCCC1
InChIInChI=1S/C6H11NO.C3H8O/c8-7-6-4-2-1-3-5-6;1-3(2)4/h8H,1-5H2;3-4H,1-2H3
InChIKeyDCTDAOGVGQHNJW-UHFFFAOYSA-N
XLogP2.17
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', '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 N-cyclohexylidenehydroxylamine;propan-2-ol?
The IUPAC name of N-cyclohexylidenehydroxylamine;propan-2-ol (CID 175240133) is N-cyclohexylidenehydroxylamine;propan-2-ol.
What is the SMILES notation for N-cyclohexylidenehydroxylamine;propan-2-ol?
The canonical SMILES for N-cyclohexylidenehydroxylamine;propan-2-ol is CC(C)O.ON=C1CCCCC1.
What is the InChIKey of N-cyclohexylidenehydroxylamine;propan-2-ol?
The InChIKey is DCTDAOGVGQHNJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.C3H8O/c8-7-6-4-2-1-3-5-6;1-3(2)4/h8H,1-5H2;3-4H,1-2H3.
What are the key properties of N-cyclohexylidenehydroxylamine;propan-2-ol?
N-cyclohexylidenehydroxylamine;propan-2-ol has a molecular weight of 173.26 g/mol, XLogP of 2.17, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylidenehydroxylamine;propan-2-ol is sourced from PubChem (CID 175240133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).