2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide

C19H17ClN2O — CID 3974047

IUPAC2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide
SMILESO=C(CNCc1ccccc1Cl)Nc1cccc2ccccc12
InChIInChI=1S/C19H17ClN2O/c20-17-10-4-2-7-15(17)12-21-13-19(23)22-18-11-5-8-14-6-1-3-9-16(14)18/h1-11,21H,12-13H2,(H,22,23)
InChIKeyXNUVQXHHQQHEIY-UHFFFAOYSA-N
MW324.81 g/mol
LogP4.22
Rot. Bonds5

About 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide

2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide (PubChem CID 3974047) has the molecular formula C19H17ClN2O and a molecular weight of 324.81 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide
PubChem CID3974047
Molecular FormulaC19H17ClN2O
Molecular Weight324.81 g/mol
Exact Mass324.10
IUPAC Name2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide
SMILESO=C(CNCc1ccccc1Cl)Nc1cccc2ccccc12
InChIInChI=1S/C19H17ClN2O/c20-17-10-4-2-7-15(17)12-21-13-19(23)22-18-11-5-8-14-6-1-3-9-16(14)18/h1-11,21H,12-13H2,(H,22,23)
InChIKeyXNUVQXHHQQHEIY-UHFFFAOYSA-N
XLogP4.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.81
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chlorophenyl)methylamino]-N-(2,6-dichlorophenyl)acetamide
CID 43405213
N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide
CID 108997968
1-[(2-chlorophenyl)methyl]-3-naphthalen-1-ylthiourea
CID 19650053
2-[(2-chlorophenyl)methylamino]-N-(3,5-dichlorophenyl)acetamide
CID 54832861
2-(naphthalen-1-ylmethylamino)-N-(2-nitrophenyl)acetamide
CID 5115810
2-[2-(hydroxymethyl)anilino]-N-naphthalen-1-ylacetamide
CID 176907917
N,N'-dinaphthalen-1-ylbutanediamide
CID 1346643
2-anilino-N-naphthalen-1-ylacetamide
CID 767556
2-(2-fluorophenyl)-N-naphthalen-1-ylacetamide
CID 836511
N-(2,6-dichlorophenyl)-2-[(2-methylphenyl)methylamino]acetamide
CID 60695302
N-[(2-chlorophenyl)methyl]-N'-(2,3-dichlorophenyl)propanediamide
CID 108946674
3-[[2-[(2-chlorophenyl)methylamino]acetyl]amino]-N-isoquinolin-3-ylpropanamide
CID 174615679

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide (CID 3974047) is 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide is O=C(CNCc1ccccc1Cl)Nc1cccc2ccccc12.
What is the InChIKey of 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide?
The InChIKey is XNUVQXHHQQHEIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O/c20-17-10-4-2-7-15(17)12-21-13-19(23)22-18-11-5-8-14-6-1-3-9-16(14)18/h1-11,21H,12-13H2,(H,22,23).
What are the key properties of 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide?
2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide has a molecular weight of 324.81 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 3974047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).