(6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone

C19H17FN6O — CID 117073399

IUPAC(6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone
SMILESO=C(c1nc2ccc(F)cc2[nH]1)N1CCN(c2ccc3[nH]ncc3c2)CC1
InChIInChI=1S/C19H17FN6O/c20-13-1-3-16-17(10-13)23-18(22-16)19(27)26-7-5-25(6-8-26)14-2-4-15-12(9-14)11-21-24-15/h1-4,9-11H,5-8H2,(H,21,24)(H,22,23)
InChIKeyGHWGYKRKSLXNKY-UHFFFAOYSA-N
MW364.38 g/mol
LogP2.54
Rot. Bonds2

About (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone

(6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone (PubChem CID 117073399) has the molecular formula C19H17FN6O and a molecular weight of 364.38 g/mol. Its IUPAC name is (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone
PubChem CID117073399
Molecular FormulaC19H17FN6O
Molecular Weight364.38 g/mol
Exact Mass364.14
IUPAC Name(6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone
SMILESO=C(c1nc2ccc(F)cc2[nH]1)N1CCN(c2ccc3[nH]ncc3c2)CC1
InChIInChI=1S/C19H17FN6O/c20-13-1-3-16-17(10-13)23-18(22-16)19(27)26-7-5-25(6-8-26)14-2-4-15-12(9-14)11-21-24-15/h1-4,9-11H,5-8H2,(H,21,24)(H,22,23)
InChIKeyGHWGYKRKSLXNKY-UHFFFAOYSA-N
XLogP2.54
TPSA80.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.38
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone with MolForge

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Related Compounds

[4-(4-fluorophenyl)piperazin-1-yl]-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]methanone
CID 71690227
(4-quinazolin-6-ylpiperazin-1-yl)-(1H-1,2,4-triazol-5-yl)methanone
CID 126894181
[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-(5,6-dimethyl-1H-benzimidazol-2-yl)methanone
CID 142695591
(7-fluoro-2-methylquinolin-4-yl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone
CID 55604624
(2R)-2-amino-1-[4-(1H-indazol-5-yl)piperazin-1-yl]-3-phenylpropan-1-one
CID 16662104
(6-fluoro-1H-benzimidazol-2-yl)-[(3S)-3-(5-methyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
CID 99932216
2-(4-fluorophenyl)-1-[4-(2-methyl-3H-benzimidazol-5-yl)piperazin-1-yl]ethanone
CID 110643384
ethyl N-[[(3S,4S)-1-(6-fluoro-1H-benzimidazole-2-carbonyl)-3-hydroxypiperidin-4-yl]methyl]carbamate
CID 56894443
[4-(3,4-dichlorophenyl)piperazin-1-yl]-(4-fluorophenyl)methanone
CID 17217210
(6-bromo-1H-benzimidazol-2-yl)-morpholin-4-ylmethanone
CID 129160689
(3,4-dimethylphenyl)-[4-(2-methyl-3H-benzimidazol-5-yl)piperazin-1-yl]methanone
CID 110643379
[2-(4-methylpiperazine-1-carbonyl)-3H-benzimidazol-5-yl]-phenylmethanone
CID 10360375

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone?
The IUPAC name of (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone (CID 117073399) is (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone.
What is the SMILES notation for (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone?
The canonical SMILES for (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone is O=C(c1nc2ccc(F)cc2[nH]1)N1CCN(c2ccc3[nH]ncc3c2)CC1.
What is the InChIKey of (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone?
The InChIKey is GHWGYKRKSLXNKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN6O/c20-13-1-3-16-17(10-13)23-18(22-16)19(27)26-7-5-25(6-8-26)14-2-4-15-12(9-14)11-21-24-15/h1-4,9-11H,5-8H2,(H,21,24)(H,22,23).
What are the key properties of (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone?
(6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone has a molecular weight of 364.38 g/mol, XLogP of 2.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-1H-benzimidazol-2-yl)-[4-(1H-indazol-5-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 117073399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).