(NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine

C10H13NO3 — CID 96551764

IUPAC(NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine
SMILESCOc1cc(OC)cc(/C(C)=N\O)c1
InChIInChI=1S/C10H13NO3/c1-7(11-12)8-4-9(13-2)6-10(5-8)14-3/h4-6,12H,1-3H3/b11-7-
InChIKeyPFCSYXAOKGKSBA-XFFZJAGNSA-N
MW195.22 g/mol
LogP1.90
Rot. Bonds3

About (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine

(NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine (PubChem CID 96551764) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine
PubChem CID96551764
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name(NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine
SMILESCOc1cc(OC)cc(/C(C)=N\O)c1
InChIInChI=1S/C10H13NO3/c1-7(11-12)8-4-9(13-2)6-10(5-8)14-3/h4-6,12H,1-3H3/b11-7-
InChIKeyPFCSYXAOKGKSBA-XFFZJAGNSA-N
XLogP1.90
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

N-[1-(4-methoxy-3,5-dimethylphenyl)ethylidene]hydroxylamine
CID 56607063
N-[1-[4-(4-methoxyphenyl)phenyl]ethylidene]hydroxylamine
CID 87865023
[(E)-1-(3,5-dimethoxyphenyl)ethylideneamino]urea
CID 121221771
1-(3,5-dimethoxyphenyl)ethanone;ethane
CID 142226820
phosphane;1,3,5-trimethoxybenzene
CID 175232895
N-[1-[3-[2-(4-methoxyphenyl)ethoxy]phenyl]ethylidene]hydroxylamine
CID 77069669
N-[4-(N-hydroxy-C-methylcarbonimidoyl)phenyl]-3-methoxybenzamide
CID 74313239
2-[(Z)-N-hydroxy-C-methylcarbonimidoyl]-5-methoxyphenol
CID 137082808
3,5-dimethoxybenzoyl fluoride
CID 102051744
1-(3-methoxyphenyl)-N-[1-(3-methoxyphenyl)ethylideneamino]ethanimine
CID 791623
3-(3,5-dimethoxyphenyl)but-2-en-1-ol
CID 54436629
3-(3,5-dimethoxyphenyl)but-2-enal
CID 57055775

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine (CID 96551764) is (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine is COc1cc(OC)cc(/C(C)=N\O)c1.
What is the InChIKey of (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine?
The InChIKey is PFCSYXAOKGKSBA-XFFZJAGNSA-N. The full InChI is InChI=1S/C10H13NO3/c1-7(11-12)8-4-9(13-2)6-10(5-8)14-3/h4-6,12H,1-3H3/b11-7-.
What are the key properties of (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine?
(NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine has a molecular weight of 195.22 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-(3,5-dimethoxyphenyl)ethylidene]hydroxylamine is sourced from PubChem (CID 96551764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).