(NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine

C11H14N2O — CID 7058762

IUPAC(NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine
SMILESO/N=C1\CCCC[C@H]1c1ccccn1
InChIInChI=1S/C11H14N2O/c14-13-11-7-2-1-5-9(11)10-6-3-4-8-12-10/h3-4,6,8-9,14H,1-2,5,7H2/b13-11+/t9-/m0/s1
InChIKeyGVMAYKQRHPICEB-QYARFRDLSA-N
MW190.25 g/mol
LogP2.57
Rot. Bonds1

About (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine

(NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine (PubChem CID 7058762) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine
PubChem CID7058762
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name(NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine
SMILESO/N=C1\CCCC[C@H]1c1ccccn1
InChIInChI=1S/C11H14N2O/c14-13-11-7-2-1-5-9(11)10-6-3-4-8-12-10/h3-4,6,8-9,14H,1-2,5,7H2/b13-11+/t9-/m0/s1
InChIKeyGVMAYKQRHPICEB-QYARFRDLSA-N
XLogP2.57
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 52.57
H-Bond Donors ≤ 51
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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Related Compounds

(NE)-N-[(2S)-2-pyridin-2-ylcyclopentylidene]hydroxylamine
CID 7447533
[(2-pyridin-2-ylcyclohexylidene)amino]urea
CID 5146946
[(E)-[(2R)-2-pyridin-2-ylcyclohexylidene]amino]urea
CID 98151079
(NE)-N-[(2R)-2-phenylcyclohexylidene]hydroxylamine
CID 98298121
2-[(1S,2Z)-2-(phenylcarbamothioylhydrazinylidene)cyclohexyl]pyridine-4-carboxylic acid
CID 27331592
(NE)-N-[2-(2,3,4-trimethoxyphenyl)cyclohexylidene]hydroxylamine
CID 5380531
(NZ)-N-[2-(3-methoxyphenyl)cyclohexylidene]hydroxylamine
CID 6183979
2-(3,5,7-tripyridin-2-ylcyclooctyl)pyridine
CID 58652114
(NE)-N-(2-benzylcyclooctylidene)hydroxylamine
CID 88834321
3-pyridin-2-ylcyclodecan-1-one
CID 175713281
7-pyridin-2-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine
CID 162743847
(NE)-N-[2-(1H-benzimidazol-2-ylsulfanyl)cyclooctylidene]hydroxylamine
CID 6264734

Frequently Asked Questions

What is the IUPAC name of (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine?
The IUPAC name of (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine (CID 7058762) is (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine is O/N=C1\CCCC[C@H]1c1ccccn1.
What is the InChIKey of (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine?
The InChIKey is GVMAYKQRHPICEB-QYARFRDLSA-N. The full InChI is InChI=1S/C11H14N2O/c14-13-11-7-2-1-5-9(11)10-6-3-4-8-12-10/h3-4,6,8-9,14H,1-2,5,7H2/b13-11+/t9-/m0/s1.
What are the key properties of (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine?
(NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine has a molecular weight of 190.25 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[(2S)-2-pyridin-2-ylcyclohexylidene]hydroxylamine is sourced from PubChem (CID 7058762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).