(NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine

C14H17NO — CID 46221099

IUPAC(NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine
SMILESC=C1CCCCC1/C(=N\O)c1ccccc1
InChIInChI=1S/C14H17NO/c1-11-7-5-6-10-13(11)14(15-16)12-8-3-2-4-9-12/h2-4,8-9,13,16H,1,5-7,10H2/b15-14-
InChIKeyUOVXMJMPLRUOMD-PFONDFGASA-N
MW215.30 g/mol
LogP3.61
Rot. Bonds2

About (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine

(NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine (PubChem CID 46221099) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine
PubChem CID46221099
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name(NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine
SMILESC=C1CCCCC1/C(=N\O)c1ccccc1
InChIInChI=1S/C14H17NO/c1-11-7-5-6-10-13(11)14(15-16)12-8-3-2-4-9-12/h2-4,8-9,13,16H,1,5-7,10H2/b15-14-
InChIKeyUOVXMJMPLRUOMD-PFONDFGASA-N
XLogP3.61
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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

(2-methylidenecycloheptyl)-phenylmethanone
CID 100964803
[(1S)-2-methylidenecycloheptyl]-phenylmethanone
CID 102046859
(NZ)-N-[phenyl(piperidin-2-yl)methylidene]hydroxylamine
CID 82396550
2-methylidenecyclohexane-1-carboxylic acid
CID 14111060
2-benzoylcyclotridecan-1-one
CID 101422484
(R)-(2-methylidenecyclohexyl)-phenylmethanol
CID 101364678
(NE)-N-[cyclopenta-2,4-dien-1-yl(phenyl)methylidene]hydroxylamine
CID 11987098
N-[(2-methylidenecyclohexyl)methylcarbamothioyl]benzamide
CID 89316401
(NZ)-N-[(2S)-2-phenylcyclohexylidene]hydroxylamine
CID 92524008
(NE)-N-[(2R)-2-phenylcyclohexylidene]hydroxylamine
CID 98298121
1-cyclohexyl-4-[(E)-N-hydroxy-C-phenylcarbonimidoyl]pyrrolidin-2-one
CID 51055508
(NZ)-N-[phenyl(3-tricyclo[2.2.1.02,6]heptanyl)methylidene]hydroxylamine
CID 6369716

Frequently Asked Questions

What is the IUPAC name of (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine?
The IUPAC name of (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine (CID 46221099) is (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine is C=C1CCCCC1/C(=N\O)c1ccccc1.
What is the InChIKey of (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine?
The InChIKey is UOVXMJMPLRUOMD-PFONDFGASA-N. The full InChI is InChI=1S/C14H17NO/c1-11-7-5-6-10-13(11)14(15-16)12-8-3-2-4-9-12/h2-4,8-9,13,16H,1,5-7,10H2/b15-14-.
What are the key properties of (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine?
(NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine has a molecular weight of 215.30 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[(2-methylidenecyclohexyl)-phenylmethylidene]hydroxylamine is sourced from PubChem (CID 46221099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).