N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide

C23H20N4O3 — CID 166155672

IUPACN-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide
SMILESCc1nc2ccc(C(=O)Nc3ccc(Oc4ccccc4C(N)=O)cc3)cc2n1C
InChIInChI=1S/C23H20N4O3/c1-14-25-19-12-7-15(13-20(19)27(14)2)23(29)26-16-8-10-17(11-9-16)30-21-6-4-3-5-18(21)22(24)28/h3-13H,1-2H3,(H2,24,28)(H,26,29)
InChIKeyOZTNOMYPJMPTSS-UHFFFAOYSA-N
MW400.44 g/mol
LogP4.03
Rot. Bonds5

About N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide

N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide (PubChem CID 166155672) has the molecular formula C23H20N4O3 and a molecular weight of 400.44 g/mol. Its IUPAC name is N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide
PubChem CID166155672
Molecular FormulaC23H20N4O3
Molecular Weight400.44 g/mol
Exact Mass400.15
IUPAC NameN-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide
SMILESCc1nc2ccc(C(=O)Nc3ccc(Oc4ccccc4C(N)=O)cc3)cc2n1C
InChIInChI=1S/C23H20N4O3/c1-14-25-19-12-7-15(13-20(19)27(14)2)23(29)26-16-8-10-17(11-9-16)30-21-6-4-3-5-18(21)22(24)28/h3-13H,1-2H3,(H2,24,28)(H,26,29)
InChIKeyOZTNOMYPJMPTSS-UHFFFAOYSA-N
XLogP4.03
TPSA99.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.44
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-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

N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide
CID 99824184
1,2-dimethyl-N-phenylbenzimidazole-5-carboxamide
CID 110765831
N-[4-(2-carbamoylphenoxy)phenyl]-6-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 166155502
N-[4-(2-methoxyphenoxy)phenyl]-1,2,5-trimethylpyrrole-3-carboxamide
CID 9182918
2-(2,6-dimethylphenyl)-N-(3,4-dimethylphenyl)-3-methylbenzimidazole-5-carboxamide
CID 66965608
N-(1,2-dimethylbenzimidazol-5-yl)-4-methylbenzamide
CID 711844
ethyl 5-[[3-(4-fluorophenyl)-2-methylbenzimidazole-5-carbonyl]amino]-2-[(6-methyl-3-pyridinyl)oxy]benzoate
CID 70964135
N-[4-(2-methoxyphenoxy)phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide
CID 27901826
2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide
CID 169323335
N-(3,4-difluorophenyl)-1,2-dimethylbenzimidazole-5-carboxamide
CID 110765870
N-(4-acetylphenyl)-2-phenoxybenzamide
CID 2476949
N-(1-methylbenzimidazol-2-yl)-4-phenoxybenzamide
CID 72725713

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide?
The IUPAC name of N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide (CID 166155672) is N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide.
What is the SMILES notation for N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide?
The canonical SMILES for N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide is Cc1nc2ccc(C(=O)Nc3ccc(Oc4ccccc4C(N)=O)cc3)cc2n1C.
What is the InChIKey of N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide?
The InChIKey is OZTNOMYPJMPTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O3/c1-14-25-19-12-7-15(13-20(19)27(14)2)23(29)26-16-8-10-17(11-9-16)30-21-6-4-3-5-18(21)22(24)28/h3-13H,1-2H3,(H2,24,28)(H,26,29).
What are the key properties of N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide?
N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide has a molecular weight of 400.44 g/mol, XLogP of 4.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-carbamoylphenoxy)phenyl]-2,3-dimethylbenzimidazole-5-carboxamide is sourced from PubChem (CID 166155672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).