5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide

C18H24N6O2 — CID 164643695

IUPAC5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide
SMILESNC(=O)C1CC(C2CCN(C(=O)Cn3cnc4ccccc43)CC2)NN1
InChIInChI=1S/C18H24N6O2/c19-18(26)15-9-14(21-22-15)12-5-7-23(8-6-12)17(25)10-24-11-20-13-3-1-2-4-16(13)24/h1-4,11-12,14-15,21-22H,5-10H2,(H2,19,26)
InChIKeyQPDJMQCSVQXBMA-UHFFFAOYSA-N
MW356.43 g/mol
LogP-0.00
Rot. Bonds4

About 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide

5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide (PubChem CID 164643695) has the molecular formula C18H24N6O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide
PubChem CID164643695
Molecular FormulaC18H24N6O2
Molecular Weight356.43 g/mol
Exact Mass356.20
IUPAC Name5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide
SMILESNC(=O)C1CC(C2CCN(C(=O)Cn3cnc4ccccc43)CC2)NN1
InChIInChI=1S/C18H24N6O2/c19-18(26)15-9-14(21-22-15)12-5-7-23(8-6-12)17(25)10-24-11-20-13-3-1-2-4-16(13)24/h1-4,11-12,14-15,21-22H,5-10H2,(H2,19,26)
InChIKeyQPDJMQCSVQXBMA-UHFFFAOYSA-N
XLogP-0.00
TPSA105.28 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 5-0.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-(benzimidazol-1-yl)-1-[4-(triazol-2-yl)piperidin-1-yl]ethanone
CID 121164964
1-[1-[2-(benzimidazol-1-yl)acetyl]azetidin-3-yl]piperidine-4-carboxamide
CID 121153996
2-(benzimidazol-1-yl)-1-(4-pyrimidin-2-yloxypiperidin-1-yl)ethanone
CID 90558579
2-(benzimidazol-1-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
CID 110106026
[2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
CID 2422296
[2-(azepan-1-yl)-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
CID 3692305
[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
CID 5031162
[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
CID 2436915
1-(benzimidazol-1-ylmethyl)piperidine-4-carboxamide
CID 2809739
5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]-3-(2,3-dihydro-1H-inden-2-yl)-5-methylimidazolidine-2,4-dione
CID 45174056
1-[(3R)-3-aminopyrrolidin-1-yl]-3-(benzimidazol-1-yl)propan-1-one
CID 119410362
2-(benzimidazol-1-yl)-1-[(3S,4S)-3-hydroxy-4-pyrrolidin-1-ylpyrrolidin-1-yl]ethanone
CID 91779865

Frequently Asked Questions

What is the IUPAC name of 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide?
The IUPAC name of 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide (CID 164643695) is 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide?
The canonical SMILES for 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide is NC(=O)C1CC(C2CCN(C(=O)Cn3cnc4ccccc43)CC2)NN1.
What is the InChIKey of 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide?
The InChIKey is QPDJMQCSVQXBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O2/c19-18(26)15-9-14(21-22-15)12-5-7-23(8-6-12)17(25)10-24-11-20-13-3-1-2-4-16(13)24/h1-4,11-12,14-15,21-22H,5-10H2,(H2,19,26).
What are the key properties of 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide?
5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide has a molecular weight of 356.43 g/mol, XLogP of -0.00, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[2-(benzimidazol-1-yl)acetyl]piperidin-4-yl]pyrazolidine-3-carboxamide is sourced from PubChem (CID 164643695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).