N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide

C17H17N3O3 — CID 2994717

IUPACN-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
InChIInChI=1S/C17H17N3O3/c1-2-9-23-13-6-3-11(4-7-13)16(21)18-12-5-8-14-15(10-12)20-17(22)19-14/h3-8,10H,2,9H2,1H3,(H,18,21)(H2,19,20,22)
InChIKeyORIPWJFGDQYIIG-UHFFFAOYSA-N
MW311.34 g/mol
LogP2.90
Rot. Bonds5

About N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide

N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide (PubChem CID 2994717) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide.

Molecular Properties

Compound NameN-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide
PubChem CID2994717
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC NameN-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
InChIInChI=1S/C17H17N3O3/c1-2-9-23-13-6-3-11(4-7-13)16(21)18-12-5-8-14-15(10-12)20-17(22)19-14/h3-8,10H,2,9H2,1H3,(H,18,21)(H2,19,20,22)
InChIKeyORIPWJFGDQYIIG-UHFFFAOYSA-N
XLogP2.90
TPSA86.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide 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

[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl] 4-propoxybenzoate
CID 18074969
N-(4-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-carboxamide
CID 110692387
2-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1,3-dihydrobenzimidazole-5-carboxamide
CID 59347105
N-(3,4-dichlorophenyl)-4-propoxybenzamide
CID 4938387
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)pyridine-4-carboxamide
CID 26663415
N-(3-chlorophenyl)-4-propoxybenzamide
CID 4938336
3-fluoro-4-methyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
CID 9453257
N-[3-(2-phenoxyethoxy)phenyl]-4-propoxybenzamide
CID 17123567
N-(4-anilinophenyl)-4-propoxybenzamide
CID 4938354
4-propan-2-yl-N-(4-propoxyphenyl)benzamide
CID 17177442
N-(4-ethylphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-carboxamide
CID 110692366
N-(4-propoxyphenyl)-1H-pyrazole-4-carboxamide
CID 62328004

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide?
The IUPAC name of N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide (CID 2994717) is N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide.
What is the SMILES notation for N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide?
The canonical SMILES for N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide is CCCOc1ccc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1.
What is the InChIKey of N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide?
The InChIKey is ORIPWJFGDQYIIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c1-2-9-23-13-6-3-11(4-7-13)16(21)18-12-5-8-14-15(10-12)20-17(22)19-14/h3-8,10H,2,9H2,1H3,(H,18,21)(H2,19,20,22).
What are the key properties of N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide?
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide has a molecular weight of 311.34 g/mol, XLogP of 2.90, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide is sourced from PubChem (CID 2994717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).