N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide

C15H12FN3O — CID 947655

IUPACN-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide
SMILESO=C(NCc1nc2ccccc2[nH]1)c1ccccc1F
InChIInChI=1S/C15H12FN3O/c16-11-6-2-1-5-10(11)15(20)17-9-14-18-12-7-3-4-8-13(12)19-14/h1-8H,9H2,(H,17,20)(H,18,19)
InChIKeyUETZQRADGXPMGA-UHFFFAOYSA-N
MW269.28 g/mol
LogP2.63
Rot. Bonds3

About N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide

N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide (PubChem CID 947655) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide
PubChem CID947655
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC NameN-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide
SMILESO=C(NCc1nc2ccccc2[nH]1)c1ccccc1F
InChIInChI=1S/C15H12FN3O/c16-11-6-2-1-5-10(11)15(20)17-9-14-18-12-7-3-4-8-13(12)19-14/h1-8H,9H2,(H,17,20)(H,18,19)
InChIKeyUETZQRADGXPMGA-UHFFFAOYSA-N
XLogP2.63
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-benzimidazol-2-ylmethyl)-2-chloro-4,5-difluorobenzamide
CID 78769893
N-(1H-benzimidazol-2-ylmethyl)-2-[(4-fluorophenyl)methoxy]benzamide
CID 21008793
N-(1H-benzimidazol-2-ylmethyl)-2-bromo-3-methylbenzamide
CID 103854329
N-(1H-benzimidazol-2-ylmethyl)-3-fluoro-4-methylbenzamide
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N-(1H-benzimidazol-2-ylmethyl)-2-methylfuran-3-carboxamide
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N-(1H-benzimidazol-2-yl)-2-fluorobenzamide
CID 2166675
N-(1H-benzimidazol-2-ylmethyl)-2,5-dichloropyridine-4-carboxamide
CID 105055625
N-(1H-benzimidazol-2-ylmethyl)-2-methyl-5-methylsulfanylbenzamide
CID 134018137
N-(1H-benzimidazol-2-ylmethyl)thiophene-2-carboxamide
CID 751095
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide
CID 5297042
N-(1H-benzimidazol-2-ylmethyl)-2-chloro-4-methylbenzamide
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Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide?
The IUPAC name of N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide (CID 947655) is N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide.
What is the SMILES notation for N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide?
The canonical SMILES for N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide is O=C(NCc1nc2ccccc2[nH]1)c1ccccc1F.
What is the InChIKey of N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide?
The InChIKey is UETZQRADGXPMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c16-11-6-2-1-5-10(11)15(20)17-9-14-18-12-7-3-4-8-13(12)19-14/h1-8H,9H2,(H,17,20)(H,18,19).
What are the key properties of N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide?
N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide has a molecular weight of 269.28 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-ylmethyl)-2-fluorobenzamide is sourced from PubChem (CID 947655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).