1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide

C19H26N4O4 — CID 131922240

IUPAC1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide
SMILESCCOCC(=O)N1CCC(C(=O)Nc2ccc3nc(C(C)O)[nH]c3c2)CC1
InChIInChI=1S/C19H26N4O4/c1-3-27-11-17(25)23-8-6-13(7-9-23)19(26)20-14-4-5-15-16(10-14)22-18(21-15)12(2)24/h4-5,10,12-13,24H,3,6-9,11H2,1-2H3,(H,20,26)(H,21,22)
InChIKeyLGEQMTXARWFVTP-UHFFFAOYSA-N
MW374.44 g/mol
LogP1.83
Rot. Bonds6

About 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide

1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide (PubChem CID 131922240) has the molecular formula C19H26N4O4 and a molecular weight of 374.44 g/mol. Its IUPAC name is 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide
PubChem CID131922240
Molecular FormulaC19H26N4O4
Molecular Weight374.44 g/mol
Exact Mass374.20
IUPAC Name1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide
SMILESCCOCC(=O)N1CCC(C(=O)Nc2ccc3nc(C(C)O)[nH]c3c2)CC1
InChIInChI=1S/C19H26N4O4/c1-3-27-11-17(25)23-8-6-13(7-9-23)19(26)20-14-4-5-15-16(10-14)22-18(21-15)12(2)24/h4-5,10,12-13,24H,3,6-9,11H2,1-2H3,(H,20,26)(H,21,22)
InChIKeyLGEQMTXARWFVTP-UHFFFAOYSA-N
XLogP1.83
TPSA107.55 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 51.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-ethoxyacetyl)-N-[4-(2H-tetrazol-5-yloxy)phenyl]piperidine-4-carboxamide
CID 131889995
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-2-piperidin-4-ylacetamide
CID 131891746
1-[2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanylacetyl]-N-(1,3-benzodioxol-5-yl)piperidine-4-carboxamide
CID 41282914
N-[2-(difluoromethyl)-3H-benzimidazol-5-yl]-1-(thiolan-3-yl)piperidine-4-carboxamide
CID 128531892
N-(2-methyl-3H-benzimidazol-5-yl)cyclopropanecarboxamide
CID 53276569
N-(2-methoxy-3H-benzimidazol-5-yl)cyclopropanecarboxamide
CID 166218130
1-N-[1-(1H-benzimidazol-2-yl)ethyl]-4-N-(3,4-dichlorophenyl)piperidine-1,4-dicarboxamide
CID 171336437
2-cyano-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]acetamide
CID 168520800
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-5-(2-methylpropyl)-1H-pyrazole-3-carboxamide
CID 131939383
N-(5,6-dimethyl-2-oxo-1,3-dihydrobenzimidazol-4-yl)-1-(2-ethoxyacetyl)piperidine-4-carboxamide
CID 131904790
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-3-pyrazol-1-ylpropanamide
CID 131908353
[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]thiourea
CID 169356684

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide?
The IUPAC name of 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide (CID 131922240) is 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide is CCOCC(=O)N1CCC(C(=O)Nc2ccc3nc(C(C)O)[nH]c3c2)CC1.
What is the InChIKey of 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide?
The InChIKey is LGEQMTXARWFVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O4/c1-3-27-11-17(25)23-8-6-13(7-9-23)19(26)20-14-4-5-15-16(10-14)22-18(21-15)12(2)24/h4-5,10,12-13,24H,3,6-9,11H2,1-2H3,(H,20,26)(H,21,22).
What are the key properties of 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide?
1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 1.83, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyacetyl)-N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]piperidine-4-carboxamide is sourced from PubChem (CID 131922240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).