(NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine

C12H15NO — CID 177427914

IUPAC(NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine
SMILESO/N=C/CCC/C=C\c1ccccc1
InChIInChI=1S/C12H15NO/c14-13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3-6,8-11,14H,1-2,7H2/b8-4-,13-11+
InChIKeyPILYDDOZALKHNV-MKRIRVNLSA-N
MW189.26 g/mol
LogP3.33
Rot. Bonds5

About (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine

(NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine (PubChem CID 177427914) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine
PubChem CID177427914
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name(NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine
SMILESO/N=C/CCC/C=C\c1ccccc1
InChIInChI=1S/C12H15NO/c14-13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3-6,8-11,14H,1-2,7H2/b8-4-,13-11+
InChIKeyPILYDDOZALKHNV-MKRIRVNLSA-N
XLogP3.33
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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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[(E)-6-bromohex-1-enyl]benzene
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5-ethoxypent-1-enylbenzene
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[(E)-octadec-1-enyl]benzene
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buta-1,3-diene;6-chlorohex-1-enylbenzene
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7-phenylhept-6-en-2-one
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Frequently Asked Questions

What is the IUPAC name of (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine?
The IUPAC name of (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine (CID 177427914) is (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine is O/N=C/CCC/C=C\c1ccccc1.
What is the InChIKey of (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine?
The InChIKey is PILYDDOZALKHNV-MKRIRVNLSA-N. The full InChI is InChI=1S/C12H15NO/c14-13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3-6,8-11,14H,1-2,7H2/b8-4-,13-11+.
What are the key properties of (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine?
(NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine has a molecular weight of 189.26 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[(Z)-6-phenylhex-5-enylidene]hydroxylamine is sourced from PubChem (CID 177427914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).