N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide

C23H22N4O4 — CID 2973334

IUPACN-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide
SMILESCOc1ccccc1C(=O)Nc1ccc2c(c1)nc(CCNC(=O)c1ccco1)n2C
InChIInChI=1S/C23H22N4O4/c1-27-18-10-9-15(25-22(28)16-6-3-4-7-19(16)30-2)14-17(18)26-21(27)11-12-24-23(29)20-8-5-13-31-20/h3-10,13-14H,11-12H2,1-2H3,(H,24,29)(H,25,28)
InChIKeyWXCJZNMGWOESIZ-UHFFFAOYSA-N
MW418.45 g/mol
LogP3.40
Rot. Bonds7

About N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide

N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide (PubChem CID 2973334) has the molecular formula C23H22N4O4 and a molecular weight of 418.45 g/mol. Its IUPAC name is N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide
PubChem CID2973334
Molecular FormulaC23H22N4O4
Molecular Weight418.45 g/mol
Exact Mass418.16
IUPAC NameN-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide
SMILESCOc1ccccc1C(=O)Nc1ccc2c(c1)nc(CCNC(=O)c1ccco1)n2C
InChIInChI=1S/C23H22N4O4/c1-27-18-10-9-15(25-22(28)16-6-3-4-7-19(16)30-2)14-17(18)26-21(27)11-12-24-23(29)20-8-5-13-31-20/h3-10,13-14H,11-12H2,1-2H3,(H,24,29)(H,25,28)
InChIKeyWXCJZNMGWOESIZ-UHFFFAOYSA-N
XLogP3.40
TPSA98.39 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide (CID 2973334) is N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide is COc1ccccc1C(=O)Nc1ccc2c(c1)nc(CCNC(=O)c1ccco1)n2C.
What is the InChIKey of N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide?
The InChIKey is WXCJZNMGWOESIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O4/c1-27-18-10-9-15(25-22(28)16-6-3-4-7-19(16)30-2)14-17(18)26-21(27)11-12-24-23(29)20-8-5-13-31-20/h3-10,13-14H,11-12H2,1-2H3,(H,24,29)(H,25,28).
What are the key properties of N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide?
N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide has a molecular weight of 418.45 g/mol, XLogP of 3.40, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]furan-2-carboxamide is sourced from PubChem (CID 2973334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).