N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride

C15H15ClN2O — CID 71370220

IUPACN-naphthalen-2-ylmorpholine-4-carboximidoyl chloride
SMILESCl/C(=N\c1ccc2ccccc2c1)N1CCOCC1
InChIInChI=1S/C15H15ClN2O/c16-15(18-7-9-19-10-8-18)17-14-6-5-12-3-1-2-4-13(12)11-14/h1-6,11H,7-10H2/b17-15+
InChIKeyVOJKGIVAFZCDMC-BMRADRMJSA-N
MW274.75 g/mol
LogP3.40
Rot. Bonds1

About N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride

N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride (PubChem CID 71370220) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride.

Molecular Properties

Compound NameN-naphthalen-2-ylmorpholine-4-carboximidoyl chloride
PubChem CID71370220
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC NameN-naphthalen-2-ylmorpholine-4-carboximidoyl chloride
SMILESCl/C(=N\c1ccc2ccccc2c1)N1CCOCC1
InChIInChI=1S/C15H15ClN2O/c16-15(18-7-9-19-10-8-18)17-14-6-5-12-3-1-2-4-13(12)11-14/h1-6,11H,7-10H2/b17-15+
InChIKeyVOJKGIVAFZCDMC-BMRADRMJSA-N
XLogP3.40
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

N-phenylmorpholine-4-carboximidoyl chloride
CID 9361718
morpholin-4-yl(naphthalen-2-yl)methanimine
CID 63179433
CID 146162313
CID 146162313
3-benzoyl-2-morpholin-4-yl-1-naphthalen-2-yl-4-phenylbut-2-ene-1,4-dione
CID 71723118
anthracene;4-sulfanylmorpholine
CID 157389683
N-naphthalen-2-ylmorpholin-4-amine
CID 69398473
N'-naphthalen-2-ylcyclopropanecarboximidamide
CID 63176582
1-(2-methyl-4-morpholin-4-ylphenyl)-N-naphthalen-2-ylmethanimine
CID 126071092
1-(3-fluoro-4-morpholin-4-ylphenyl)-N-naphthalen-2-ylmethanimine
CID 126145909
(2Z)-N-hydroxynaphthalene-2-carboximidoyl chloride
CID 12014223
2-naphthalen-2-yliminoacetic acid
CID 154177451
2-(C-morpholin-4-yl-N-phenylcarbonimidoyl)sulfanylacetate
CID 9484360

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride?
The IUPAC name of N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride (CID 71370220) is N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride.
What is the SMILES notation for N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride?
The canonical SMILES for N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride is Cl/C(=N\c1ccc2ccccc2c1)N1CCOCC1.
What is the InChIKey of N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride?
The InChIKey is VOJKGIVAFZCDMC-BMRADRMJSA-N. The full InChI is InChI=1S/C15H15ClN2O/c16-15(18-7-9-19-10-8-18)17-14-6-5-12-3-1-2-4-13(12)11-14/h1-6,11H,7-10H2/b17-15+.
What are the key properties of N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride?
N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride has a molecular weight of 274.75 g/mol, XLogP of 3.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-ylmorpholine-4-carboximidoyl chloride is sourced from PubChem (CID 71370220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).