2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide

C19H26N4O — CID 16810435

IUPAC2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide
SMILESO=C(CN1CCC(c2nc3ccccc3[nH]2)CC1)NC1CCCC1
InChIInChI=1S/C19H26N4O/c24-18(20-15-5-1-2-6-15)13-23-11-9-14(10-12-23)19-21-16-7-3-4-8-17(16)22-19/h3-4,7-8,14-15H,1-2,5-6,9-13H2,(H,20,24)(H,21,22)
InChIKeyTVAQCKHSFZBKIE-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.80
Rot. Bonds4

About 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide

2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide (PubChem CID 16810435) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide
PubChem CID16810435
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide
SMILESO=C(CN1CCC(c2nc3ccccc3[nH]2)CC1)NC1CCCC1
InChIInChI=1S/C19H26N4O/c24-18(20-15-5-1-2-6-15)13-23-11-9-14(10-12-23)19-21-16-7-3-4-8-17(16)22-19/h3-4,7-8,14-15H,1-2,5-6,9-13H2,(H,20,24)(H,21,22)
InChIKeyTVAQCKHSFZBKIE-UHFFFAOYSA-N
XLogP2.80
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide?
The IUPAC name of 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide (CID 16810435) is 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide?
The canonical SMILES for 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide is O=C(CN1CCC(c2nc3ccccc3[nH]2)CC1)NC1CCCC1.
What is the InChIKey of 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide?
The InChIKey is TVAQCKHSFZBKIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c24-18(20-15-5-1-2-6-15)13-23-11-9-14(10-12-23)19-21-16-7-3-4-8-17(16)22-19/h3-4,7-8,14-15H,1-2,5-6,9-13H2,(H,20,24)(H,21,22).
What are the key properties of 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide?
2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide has a molecular weight of 326.44 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cyclopentylacetamide is sourced from PubChem (CID 16810435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).