N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide

C17H13ClN2O — CID 115669454

IUPACN-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide
SMILESO=C(Cc1cccc2ccccc12)Nc1cccc(Cl)n1
InChIInChI=1S/C17H13ClN2O/c18-15-9-4-10-16(19-15)20-17(21)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H,19,20,21)
InChIKeyZHBIRNHVMKVERZ-UHFFFAOYSA-N
MW296.76 g/mol
LogP4.07
Rot. Bonds3

About N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide

N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide (PubChem CID 115669454) has the molecular formula C17H13ClN2O and a molecular weight of 296.76 g/mol. Its IUPAC name is N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide
PubChem CID115669454
Molecular FormulaC17H13ClN2O
Molecular Weight296.76 g/mol
Exact Mass296.07
IUPAC NameN-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide
SMILESO=C(Cc1cccc2ccccc12)Nc1cccc(Cl)n1
InChIInChI=1S/C17H13ClN2O/c18-15-9-4-10-16(19-15)20-17(21)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H,19,20,21)
InChIKeyZHBIRNHVMKVERZ-UHFFFAOYSA-N
XLogP4.07
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.76
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-naphthalen-1-yl-N-pyridin-2-ylacetamide;hydrochloride
CID 163331171
N-(6-chloro-2-pyridinyl)naphthalene-1-carboxamide
CID 115683288
N-(2-ethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228282
N-(4-ethyl-1H-pyrazol-5-yl)-2-naphthalen-1-ylacetamide
CID 115680720
N-(6-chloro-2-pyridinyl)-4,4,4-trifluorobutanamide
CID 115683234
2-(4-chlorophenyl)-N'-(2-naphthalen-1-ylacetyl)acetohydrazide
CID 4936833
N-(2-bromophenyl)-2-naphthalen-1-ylacetamide
CID 835456
methyl 4-[(2-naphthalen-1-ylacetyl)amino]-1H-pyrazole-5-carboxylate
CID 52941226
N-[5-[(2,3-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-2-naphthalen-1-ylacetamide
CID 2282754
trimethyl-[(2-naphthalen-1-ylacetyl)amino]azanium
CID 872172
N-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]-2-naphthalen-1-ylacetamide
CID 3633508
N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228165

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide?
The IUPAC name of N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide (CID 115669454) is N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide is O=C(Cc1cccc2ccccc12)Nc1cccc(Cl)n1.
What is the InChIKey of N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide?
The InChIKey is ZHBIRNHVMKVERZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O/c18-15-9-4-10-16(19-15)20-17(21)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H,19,20,21).
What are the key properties of N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide?
N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide has a molecular weight of 296.76 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 115669454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).