N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide

C18H18N4O3S — CID 18105121

IUPACN-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide
SMILESO=C(NCc1nc2ccccc2[nH]1)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C18H18N4O3S/c23-18(19-11-17-20-15-6-1-2-7-16(15)21-17)12-4-3-5-14(10-12)26(24,25)22-13-8-9-13/h1-7,10,13,22H,8-9,11H2,(H,19,23)(H,20,21)
InChIKeyZWMWYCWAPCGVOE-UHFFFAOYSA-N
MW370.43 g/mol
LogP1.93
Rot. Bonds6

About N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide

N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide (PubChem CID 18105121) has the molecular formula C18H18N4O3S and a molecular weight of 370.43 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide
PubChem CID18105121
Molecular FormulaC18H18N4O3S
Molecular Weight370.43 g/mol
Exact Mass370.11
IUPAC NameN-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide
SMILESO=C(NCc1nc2ccccc2[nH]1)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C18H18N4O3S/c23-18(19-11-17-20-15-6-1-2-7-16(15)21-17)12-4-3-5-14(10-12)26(24,25)22-13-8-9-13/h1-7,10,13,22H,8-9,11H2,(H,19,23)(H,20,21)
InChIKeyZWMWYCWAPCGVOE-UHFFFAOYSA-N
XLogP1.93
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 51.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-benzimidazol-2-ylmethyl)-3-piperidin-1-ylsulfonylbenzamide
CID 2333186
N-[1-(1H-benzimidazol-2-yl)-3-methylbutyl]-3-(cyclopropylsulfamoyl)benzamide
CID 55430406
3-(cyclopropylsulfamoyl)-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 87041364
N-(1H-benzimidazol-2-ylmethyl)-6-(cyclopropylamino)pyridine-3-carboxamide
CID 71937473
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-(cyclopentylsulfamoyl)benzamide
CID 55938807
N-(1H-benzimidazol-2-ylmethyl)-2-[4-(cyclopropylcarbamoyl)phenyl]pyridine-4-carboxamide
CID 117092012
N-[3-(1H-benzimidazol-2-yl)propyl]-3-(ethylsulfamoyl)benzamide
CID 30359896
N-[2-(1H-benzimidazol-2-yl)ethyl]-3-(cyclopentylsulfamoyl)-4-methylbenzamide
CID 154840886
N-(1H-benzimidazol-2-ylmethyl)-2,1,3-benzothiadiazole-5-carboxamide
CID 21008804
N-[2-(benzylamino)-2-oxoethyl]-3-(cyclopropylsulfamoyl)benzamide
CID 39821970
N-(1H-benzimidazol-2-ylmethyl)-4-(phenylsulfamoyl)benzamide
CID 18105180
3-(cyclopentylsulfamoyl)-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 87041602

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide?
The IUPAC name of N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide (CID 18105121) is N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide.
What is the SMILES notation for N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide?
The canonical SMILES for N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide is O=C(NCc1nc2ccccc2[nH]1)c1cccc(S(=O)(=O)NC2CC2)c1.
What is the InChIKey of N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide?
The InChIKey is ZWMWYCWAPCGVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3S/c23-18(19-11-17-20-15-6-1-2-7-16(15)21-17)12-4-3-5-14(10-12)26(24,25)22-13-8-9-13/h1-7,10,13,22H,8-9,11H2,(H,19,23)(H,20,21).
What are the key properties of N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide?
N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide has a molecular weight of 370.43 g/mol, XLogP of 1.93, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide is sourced from PubChem (CID 18105121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).