N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide

C19H15N3O2 — CID 2583317

IUPACN-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide
SMILESO=C(COc1cccc2ccccc12)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C19H15N3O2/c23-18(22-19-20-15-9-3-4-10-16(15)21-19)12-24-17-11-5-7-13-6-1-2-8-14(13)17/h1-11H,12H2,(H2,20,21,22,23)
InChIKeyCXXQEMDABUQNTR-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.73
Rot. Bonds4

About N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide

N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide (PubChem CID 2583317) has the molecular formula C19H15N3O2 and a molecular weight of 317.35 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide
PubChem CID2583317
Molecular FormulaC19H15N3O2
Molecular Weight317.35 g/mol
Exact Mass317.12
IUPAC NameN-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide
SMILESO=C(COc1cccc2ccccc12)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C19H15N3O2/c23-18(22-19-20-15-9-3-4-10-16(15)21-19)12-24-17-11-5-7-13-6-1-2-8-14(13)17/h1-11H,12H2,(H2,20,21,22,23)
InChIKeyCXXQEMDABUQNTR-UHFFFAOYSA-N
XLogP3.73
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide (CID 2583317) is N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide is O=C(COc1cccc2ccccc12)Nc1nc2ccccc2[nH]1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide?
The InChIKey is CXXQEMDABUQNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2/c23-18(22-19-20-15-9-3-4-10-16(15)21-19)12-24-17-11-5-7-13-6-1-2-8-14(13)17/h1-11H,12H2,(H2,20,21,22,23).
What are the key properties of N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide?
N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide has a molecular weight of 317.35 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-2-naphthalen-1-yloxyacetamide is sourced from PubChem (CID 2583317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).