(NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine

C13H17NO — CID 177415583

IUPAC(NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine
SMILESCC(C)=CC/C(=N/O)c1ccc(C)cc1
InChIInChI=1S/C13H17NO/c1-10(2)4-9-13(14-15)12-7-5-11(3)6-8-12/h4-8,15H,9H2,1-3H3/b14-13-
InChIKeyWXSYYBHSIZPVIG-YPKPFQOOSA-N
MW203.28 g/mol
LogP3.53
Rot. Bonds3

About (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine

(NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine (PubChem CID 177415583) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine
PubChem CID177415583
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name(NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine
SMILESCC(C)=CC/C(=N/O)c1ccc(C)cc1
InChIInChI=1S/C13H17NO/c1-10(2)4-9-13(14-15)12-7-5-11(3)6-8-12/h4-8,15H,9H2,1-3H3/b14-13-
InChIKeyWXSYYBHSIZPVIG-YPKPFQOOSA-N
XLogP3.53
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 53.53
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'}

Analyze (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(4-methylphenyl)propylidene]hydroxylamine
CID 7174004
N-[2-chloro-1-(4-methylphenyl)ethylidene]hydroxylamine
CID 85344533
(NE)-N-[1-(4-methylphenyl)butylidene]hydroxylamine
CID 12707912
1-methyl-4-[(2E,5E)-6-(4-methylphenyl)hepta-2,5-dien-2-yl]benzene
CID 169013280
(NE)-N-[2-ethylsulfonyl-1-(4-methylphenyl)ethylidene]hydroxylamine
CID 102550852
ethane;(NE)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine
CID 172965019
N-[1-hydroxyimino-1-(4-methylphenyl)butan-2-ylidene]hydroxylamine
CID 135541210
(E)-N'-hydroxy-3-(4-methylphenyl)but-2-enimidamide
CID 91294763
(NE)-N-[1-(4-chlorophenyl)-2-(4-methylphenyl)sulfonylethylidene]hydroxylamine
CID 134852362
1-[(Z)-but-2-en-2-yl]-4-methylbenzene
CID 58843251
1-but-2-en-2-yl-4-methylbenzene
CID 12583115
3,3-difluoro-6-methyl-1-(4-methylphenyl)hept-5-en-1-one
CID 101009550

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine (CID 177415583) is (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine is CC(C)=CC/C(=N/O)c1ccc(C)cc1.
What is the InChIKey of (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine?
The InChIKey is WXSYYBHSIZPVIG-YPKPFQOOSA-N. The full InChI is InChI=1S/C13H17NO/c1-10(2)4-9-13(14-15)12-7-5-11(3)6-8-12/h4-8,15H,9H2,1-3H3/b14-13-.
What are the key properties of (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine?
(NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine has a molecular weight of 203.28 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[4-methyl-1-(4-methylphenyl)pent-3-enylidene]hydroxylamine is sourced from PubChem (CID 177415583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).