2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide

C14H13N3O2 — CID 2357239

IUPAC2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(Cc1nc2ccccc2[nH]1)NCc1ccco1
InChIInChI=1S/C14H13N3O2/c18-14(15-9-10-4-3-7-19-10)8-13-16-11-5-1-2-6-12(11)17-13/h1-7H,8-9H2,(H,15,18)(H,16,17)
InChIKeyWHXYDNRPQKKYAE-UHFFFAOYSA-N
MW255.28 g/mol
LogP2.01
Rot. Bonds4

About 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide

2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide (PubChem CID 2357239) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide
PubChem CID2357239
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC Name2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(Cc1nc2ccccc2[nH]1)NCc1ccco1
InChIInChI=1S/C14H13N3O2/c18-14(15-9-10-4-3-7-19-10)8-13-16-11-5-1-2-6-12(11)17-13/h1-7H,8-9H2,(H,15,18)(H,16,17)
InChIKeyWHXYDNRPQKKYAE-UHFFFAOYSA-N
XLogP2.01
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide (CID 2357239) is 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide is O=C(Cc1nc2ccccc2[nH]1)NCc1ccco1.
What is the InChIKey of 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is WHXYDNRPQKKYAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c18-14(15-9-10-4-3-7-19-10)8-13-16-11-5-1-2-6-12(11)17-13/h1-7H,8-9H2,(H,15,18)(H,16,17).
What are the key properties of 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide?
2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 255.28 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-benzimidazol-2-yl)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 2357239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).