(NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine

C6H14NO4P — CID 5464780

IUPAC(NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine
SMILESCCOP(=O)(OCC)/C(C)=N\O
InChIInChI=1S/C6H14NO4P/c1-4-10-12(9,11-5-2)6(3)7-8/h8H,4-5H2,1-3H3/b7-6-
InChIKeyRCXXELSBQJKDTQ-SREVYHEPSA-N
MW195.15 g/mol
LogP2.06
Rot. Bonds5

About (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine

(NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine (PubChem CID 5464780) has the molecular formula C6H14NO4P and a molecular weight of 195.15 g/mol. Its IUPAC name is (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine
PubChem CID5464780
Molecular FormulaC6H14NO4P
Molecular Weight195.15 g/mol
Exact Mass195.07
IUPAC Name(NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine
SMILESCCOP(=O)(OCC)/C(C)=N\O
InChIInChI=1S/C6H14NO4P/c1-4-10-12(9,11-5-2)6(3)7-8/h8H,4-5H2,1-3H3/b7-6-
InChIKeyRCXXELSBQJKDTQ-SREVYHEPSA-N
XLogP2.06
TPSA68.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.15
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

Phosphonic acid, (1-oxobutyl)-, diethyl ester, oxime
CID 9588266
Diethyl N-hydroxyethanimidoylphosphonate
CID 9568507
(NE)-N-(2-diethoxyphosphorylethylidene)hydroxylamine
CID 13204159
(1Z)-2-diethoxyphosphoryl-N-hydroxyethanimidoyl chloride
CID 13547845
(NE)-N-[1-di(propan-2-yloxy)phosphorylethylidene]hydroxylamine
CID 13294122
N-(diethoxyphosphoryloxy)ethanimidoylchloride
CID 85552833
(1Z)-N-[ethoxy(methyl)phosphoryl]oxyethanimidoyl chloride
CID 134985126
(NZ)-N-(2-chloro-1-diethoxyphosphorylethylidene)hydroxylamine
CID 135084052
N-(1-diethoxyphosphorylbutylidene)hydroxylamine
CID 3056460
Dimethyl (1E)-N-hydroxyethanimidoylphosphonate
CID 9602557
Icrvbbdjzgskmp-uhfffaoysa-
CID 23260353
N-(1-diethoxyphosphorylethylidene)hydroxylamine
CID 272988

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine (CID 5464780) is (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine is CCOP(=O)(OCC)/C(C)=N\O.
What is the InChIKey of (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine?
The InChIKey is RCXXELSBQJKDTQ-SREVYHEPSA-N. The full InChI is InChI=1S/C6H14NO4P/c1-4-10-12(9,11-5-2)6(3)7-8/h8H,4-5H2,1-3H3/b7-6-.
What are the key properties of (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine?
(NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine has a molecular weight of 195.15 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(1-diethoxyphosphorylethylidene)hydroxylamine is sourced from PubChem (CID 5464780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).