1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide

C18H26N4O2 — CID 160963634

IUPAC1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide
SMILESCCOn1c(C(=O)NC2CCN(C(C)C)CC2)nc2ccccc21
InChIInChI=1S/C18H26N4O2/c1-4-24-22-16-8-6-5-7-15(16)20-17(22)18(23)19-14-9-11-21(12-10-14)13(2)3/h5-8,13-14H,4,9-12H2,1-3H3,(H,19,23)
InChIKeySXIDEYGXTAJILU-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.09
Rot. Bonds5

About 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide

1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide (PubChem CID 160963634) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide.

Molecular Properties

Compound Name1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide
PubChem CID160963634
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC Name1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide
SMILESCCOn1c(C(=O)NC2CCN(C(C)C)CC2)nc2ccccc21
InChIInChI=1S/C18H26N4O2/c1-4-24-22-16-8-6-5-7-15(16)20-17(22)18(23)19-14-9-11-21(12-10-14)13(2)3/h5-8,13-14H,4,9-12H2,1-3H3,(H,19,23)
InChIKeySXIDEYGXTAJILU-UHFFFAOYSA-N
XLogP2.09
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-propan-2-ylpiperidin-4-yl)-1-(2,2,2-trifluoroethoxy)benzimidazole-2-carboxamide
CID 142966374
2-(2-ethylbenzimidazol-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 51219854
1-methyl-N-(1-propan-2-ylpiperidin-4-yl)indole-2-carboxamide
CID 142244434
3-[2-(4-chlorophenyl)ethyl]-2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]benzimidazole-4-carboxylic acid
CID 67012577
2,6-dimethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 110751950
methyl 1-[2-(4-chlorophenyl)ethyl]-2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]benzimidazole-5-carboxylate
CID 67011940
N-(1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide
CID 25236647
2-methyl-1-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-(1-propan-2-ylpiperidin-4-yl)guanidine;hydroiodide
CID 111318625
tert-butyl 2-[2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]indol-1-yl]acetate
CID 86628722
2-(2-methylbutanoylamino)-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 131939573
4-(2-methylbutanoyl)-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 168882317
N-(1-propan-2-ylpiperidin-4-yl)-1H-indole-2-carboxamide
CID 51219847

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide?
The IUPAC name of 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide (CID 160963634) is 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide.
What is the SMILES notation for 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide?
The canonical SMILES for 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide is CCOn1c(C(=O)NC2CCN(C(C)C)CC2)nc2ccccc21.
What is the InChIKey of 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide?
The InChIKey is SXIDEYGXTAJILU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-4-24-22-16-8-6-5-7-15(16)20-17(22)18(23)19-14-9-11-21(12-10-14)13(2)3/h5-8,13-14H,4,9-12H2,1-3H3,(H,19,23).
What are the key properties of 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide?
1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzimidazole-2-carboxamide is sourced from PubChem (CID 160963634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).