N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine

C11H21NO — CID 174911020

IUPACN-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine
SMILESCC(C)(C)C1(C=NO)CCCCC1
InChIInChI=1S/C11H21NO/c1-10(2,3)11(9-12-13)7-5-4-6-8-11/h9,13H,4-8H2,1-3H3
InChIKeyGEMCGAOPFRLJAB-UHFFFAOYSA-N
MW183.30 g/mol
LogP3.44
Rot. Bonds1

About N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine

N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine (PubChem CID 174911020) has the molecular formula C11H21NO and a molecular weight of 183.30 g/mol. Its IUPAC name is N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine.

Molecular Properties

Compound NameN-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine
PubChem CID174911020
Molecular FormulaC11H21NO
Molecular Weight183.30 g/mol
Exact Mass183.16
IUPAC NameN-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine
SMILESCC(C)(C)C1(C=NO)CCCCC1
InChIInChI=1S/C11H21NO/c1-10(2,3)11(9-12-13)7-5-4-6-8-11/h9,13H,4-8H2,1-3H3
InChIKeyGEMCGAOPFRLJAB-UHFFFAOYSA-N
XLogP3.44
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 53.44
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

1-tert-butylcyclooctan-1-ol
CID 12697683
(NE)-N-[(1-piperidin-1-ylcyclopentyl)methylidene]hydroxylamine
CID 134992638
1-tert-butylcyclopropane-1-carbaldehyde
CID 12542135
1-tert-butyl-1-fluorocyclohexane
CID 13144920
1-(1,1-difluoroethyl)cyclopentane-1-carbaldehyde
CID 84764469
1-tert-butyl-1-propylcyclohexane
CID 173344260
N-tert-butyl-1-(1-methylcyclopentyl)methanimine
CID 11019239
1-tert-butyl-1-(1-tert-butylcyclohexyl)sulfanylcyclohexane
CID 174736367
1-tert-butyl-1-methylcyclopentane
CID 21351462
(2R,6R,12S,16S,17S)-17-[tert-butyl(dimethyl)silyl]oxy-16-[(E)-hydroxyiminomethyl]-4,4,12-trimethyl-3,5-dioxapentacyclo[11.7.0.02,6.07,12.016,20]icosan-14-ol
CID 172961554
trans-(1S,2S)-1-tert-butylcyclohexane-1,2-diol
CID 11969728
1-tert-butylcyclohexane-1-sulfonic acid
CID 22930345

Frequently Asked Questions

What is the IUPAC name of N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine?
The IUPAC name of N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine (CID 174911020) is N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine.
What is the SMILES notation for N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine?
The canonical SMILES for N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine is CC(C)(C)C1(C=NO)CCCCC1.
What is the InChIKey of N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine?
The InChIKey is GEMCGAOPFRLJAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(2,3)11(9-12-13)7-5-4-6-8-11/h9,13H,4-8H2,1-3H3.
What are the key properties of N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine?
N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine has a molecular weight of 183.30 g/mol, XLogP of 3.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-tert-butylcyclohexyl)methylidene]hydroxylamine is sourced from PubChem (CID 174911020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).