N-(3,5-dimethylcyclohexylidene)hydroxylamine

C8H15NO — CID 580917

IUPACN-(3,5-dimethylcyclohexylidene)hydroxylamine
SMILESCC1CC(=NO)CC(C)C1
InChIInChI=1S/C8H15NO/c1-6-3-7(2)5-8(4-6)9-10/h6-7,10H,3-5H2,1-2H3
InChIKeyBTZZWXZMJCHUFK-UHFFFAOYSA-N
MW141.21 g/mol
LogP2.27
Rot. Bonds

About N-(3,5-dimethylcyclohexylidene)hydroxylamine

N-(3,5-dimethylcyclohexylidene)hydroxylamine (PubChem CID 580917) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexylidene)hydroxylamine.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexylidene)hydroxylamine
PubChem CID580917
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-(3,5-dimethylcyclohexylidene)hydroxylamine
SMILESCC1CC(=NO)CC(C)C1
InChIInChI=1S/C8H15NO/c1-6-3-7(2)5-8(4-6)9-10/h6-7,10H,3-5H2,1-2H3
InChIKeyBTZZWXZMJCHUFK-UHFFFAOYSA-N
XLogP2.27
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 52.27
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
Cyclohexanone, 5-methyl-2-(1-methylethyl)-, oxime
CID 5789691
1,2-Cyclohexanedione, 4-methyl-, dioxime
CID 135432349
Cyclohexanone, 2-methyl-, oxime
CID 5382393
4-Methylcyclohexanone oxime
CID 236590
N-[5-methyl-2-(propan-2-yl)cyclohexylidene]hydroxylamine
CID 316352
N-(2,2,6,6-Tetramethylcyclohexylidene)hydroxylamine
CID 348405
(1Z)-2-methylcyclohexanone oxime
CID 5362692
(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

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexylidene)hydroxylamine?
The IUPAC name of N-(3,5-dimethylcyclohexylidene)hydroxylamine (CID 580917) is N-(3,5-dimethylcyclohexylidene)hydroxylamine.
What is the SMILES notation for N-(3,5-dimethylcyclohexylidene)hydroxylamine?
The canonical SMILES for N-(3,5-dimethylcyclohexylidene)hydroxylamine is CC1CC(=NO)CC(C)C1.
What is the InChIKey of N-(3,5-dimethylcyclohexylidene)hydroxylamine?
The InChIKey is BTZZWXZMJCHUFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6-3-7(2)5-8(4-6)9-10/h6-7,10H,3-5H2,1-2H3.
What are the key properties of N-(3,5-dimethylcyclohexylidene)hydroxylamine?
N-(3,5-dimethylcyclohexylidene)hydroxylamine has a molecular weight of 141.21 g/mol, XLogP of 2.27, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexylidene)hydroxylamine is sourced from PubChem (CID 580917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).