N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine

C15H19NO — CID 71327655

IUPACN-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine
SMILESCC(C)c1ccc(C2=CCCCC2=NO)cc1
InChIInChI=1S/C15H19NO/c1-11(2)12-7-9-13(10-8-12)14-5-3-4-6-15(14)16-17/h5,7-11,17H,3-4,6H2,1-2H3
InChIKeyMXTPOFHRUVKSRQ-UHFFFAOYSA-N
MW229.32 g/mol
LogP4.21
Rot. Bonds2

About N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine

N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine (PubChem CID 71327655) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine.

Molecular Properties

Compound NameN-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine
PubChem CID71327655
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC NameN-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine
SMILESCC(C)c1ccc(C2=CCCCC2=NO)cc1
InChIInChI=1S/C15H19NO/c1-11(2)12-7-9-13(10-8-12)14-5-3-4-6-15(14)16-17/h5,7-11,17H,3-4,6H2,1-2H3
InChIKeyMXTPOFHRUVKSRQ-UHFFFAOYSA-N
XLogP4.21
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 54.21
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

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CID 24808609
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1-[4-[4-(1-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-1-ol
CID 154573668
6-(4-propan-2-ylphenyl)benzene-1,2,3,4,5-pentol
CID 163506374
2,5-bis(4-propan-2-ylphenyl)benzene-1,4-diol
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formic acid;1-methyl-4-propan-2-ylbenzene
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(4-propan-2-ylphenyl)phosphane
CID 59263013
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CID 175503400
bis[4-(4-propan-2-ylphenyl)phenyl]methanone
CID 175028930

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine?
The IUPAC name of N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine (CID 71327655) is N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine.
What is the SMILES notation for N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine?
The canonical SMILES for N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine is CC(C)c1ccc(C2=CCCCC2=NO)cc1.
What is the InChIKey of N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine?
The InChIKey is MXTPOFHRUVKSRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-11(2)12-7-9-13(10-8-12)14-5-3-4-6-15(14)16-17/h5,7-11,17H,3-4,6H2,1-2H3.
What are the key properties of N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine?
N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine has a molecular weight of 229.32 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-propan-2-ylphenyl)cyclohex-2-en-1-ylidene]hydroxylamine is sourced from PubChem (CID 71327655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).