(NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine

C14H13NO — CID 101486350

IUPAC(NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine
SMILESC=CC/C(=N/O)c1ccc2ccccc2c1
InChIInChI=1S/C14H13NO/c1-2-5-14(15-16)13-9-8-11-6-3-4-7-12(11)10-13/h2-4,6-10,16H,1,5H2/b15-14-
InChIKeyRQETYLIURQDJPW-PFONDFGASA-N
MW211.26 g/mol
LogP3.59
Rot. Bonds3

About (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine

(NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine (PubChem CID 101486350) has the molecular formula C14H13NO and a molecular weight of 211.26 g/mol. Its IUPAC name is (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine
PubChem CID101486350
Molecular FormulaC14H13NO
Molecular Weight211.26 g/mol
Exact Mass211.10
IUPAC Name(NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine
SMILESC=CC/C(=N/O)c1ccc2ccccc2c1
InChIInChI=1S/C14H13NO/c1-2-5-14(15-16)13-9-8-11-6-3-4-7-12(11)10-13/h2-4,6-10,16H,1,5H2/b15-14-
InChIKeyRQETYLIURQDJPW-PFONDFGASA-N
XLogP3.59
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 53.59
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'}

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Related Compounds

(NZ)-N-(1-naphthalen-2-yl-2-naphthalen-2-yloxyethylidene)hydroxylamine
CID 122179768
(8E)-N-hydroxy-8-hydroxyimino-8-naphthalen-2-yloctanamide
CID 10903123
N-[1-(3-nitrophenyl)but-3-enylidene]hydroxylamine
CID 74340886
(2Z)-N-hydroxynaphthalene-2-carboximidoyl chloride
CID 12014223
2-[(1E)-1-chloro-1-ethoxypenta-1,4-dien-2-yl]naphthalene
CID 135004931
actinium;[(Z)-1-naphthalen-2-ylprop-1-enyl]azanide
CID 21343655
(E)-2-naphthalen-2-ylprop-1-en-1-ol
CID 70376926
2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene
CID 58787072
(Z)-3-fluoro-2-naphthalen-2-ylprop-2-en-1-ol
CID 70433227
CID 175020259
CID 175020259
2-(1,2-dinaphthalen-2-ylethenyl)naphthalene
CID 171662067
dinaphthalen-2-ylmethanone
CID 10945915

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine (CID 101486350) is (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine is C=CC/C(=N/O)c1ccc2ccccc2c1.
What is the InChIKey of (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine?
The InChIKey is RQETYLIURQDJPW-PFONDFGASA-N. The full InChI is InChI=1S/C14H13NO/c1-2-5-14(15-16)13-9-8-11-6-3-4-7-12(11)10-13/h2-4,6-10,16H,1,5H2/b15-14-.
What are the key properties of (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine?
(NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine has a molecular weight of 211.26 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(1-naphthalen-2-ylbut-3-enylidene)hydroxylamine is sourced from PubChem (CID 101486350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).