(NZ)-N-(2-methylcyclohexylidene)hydroxylamine

C7H13NO — CID 5362692

IUPAC(NZ)-N-(2-methylcyclohexylidene)hydroxylamine
SMILESCC1CCCC/C1=N/O
InChIInChI=1S/C7H13NO/c1-6-4-2-3-5-7(6)8-9/h6,9H,2-5H2,1H3/b8-7-
InChIKeyMDIFHVYPHRHKLB-FPLPWBNLSA-N
MW127.19 g/mol
LogP2.03
Rot. Bonds

About (NZ)-N-(2-methylcyclohexylidene)hydroxylamine

(NZ)-N-(2-methylcyclohexylidene)hydroxylamine (PubChem CID 5362692) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is (NZ)-N-(2-methylcyclohexylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(2-methylcyclohexylidene)hydroxylamine
PubChem CID5362692
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name(NZ)-N-(2-methylcyclohexylidene)hydroxylamine
SMILESCC1CCCC/C1=N/O
InChIInChI=1S/C7H13NO/c1-6-4-2-3-5-7(6)8-9/h6,9H,2-5H2,1H3/b8-7-
InChIKeyMDIFHVYPHRHKLB-FPLPWBNLSA-N
XLogP2.03
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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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Related Compounds

3-Methyl-5-heptanone oxime
CID 90787
1,2-Cyclohexanedione, 4-methyl-, dioxime
CID 135432349
2-Hexanone, 5-methyl-, oxime
CID 9570075
3-Hexanone, 2-methyl-, oxime
CID 57358937
Cyclohexanone, 2-methyl-, oxime
CID 5382393
4-Methylcyclohexanone oxime
CID 236590
5-Methylhexan-2-one oxime
CID 12212
(E)-2,2-Dimethylcyclohexanone oxime
CID 9562412
Methylnioxime
CID 135527135
(1E)-1-cyclohexyl-N-hydroxyethanimine
CID 9616585
N-((3E)-5-Methyl-3-heptanylidene)hydroxylamine
CID 6386962
2-Hexanone, 3-propyl-, oxime
CID 6509884

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(2-methylcyclohexylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(2-methylcyclohexylidene)hydroxylamine (CID 5362692) is (NZ)-N-(2-methylcyclohexylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(2-methylcyclohexylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(2-methylcyclohexylidene)hydroxylamine is CC1CCCC/C1=N/O.
What is the InChIKey of (NZ)-N-(2-methylcyclohexylidene)hydroxylamine?
The InChIKey is MDIFHVYPHRHKLB-FPLPWBNLSA-N. The full InChI is InChI=1S/C7H13NO/c1-6-4-2-3-5-7(6)8-9/h6,9H,2-5H2,1H3/b8-7-.
What are the key properties of (NZ)-N-(2-methylcyclohexylidene)hydroxylamine?
(NZ)-N-(2-methylcyclohexylidene)hydroxylamine has a molecular weight of 127.19 g/mol, XLogP of 2.03, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(2-methylcyclohexylidene)hydroxylamine is sourced from PubChem (CID 5362692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).