2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide

C20H23FN4O — CID 119891017

IUPAC2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide
SMILESCCCC(N)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C
InChIInChI=1S/C20H23FN4O/c1-4-5-15(22)20(26)24-16-10-13(7-6-12(16)2)19-23-17-11-14(21)8-9-18(17)25(19)3/h6-11,15H,4-5,22H2,1-3H3,(H,24,26)
InChIKeyKBDLBMHOZGWEOD-UHFFFAOYSA-N
MW354.43 g/mol
LogP3.75
Rot. Bonds5

About 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide

2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide (PubChem CID 119891017) has the molecular formula C20H23FN4O and a molecular weight of 354.43 g/mol. Its IUPAC name is 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide
PubChem CID119891017
Molecular FormulaC20H23FN4O
Molecular Weight354.43 g/mol
Exact Mass354.19
IUPAC Name2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide
SMILESCCCC(N)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C
InChIInChI=1S/C20H23FN4O/c1-4-5-15(22)20(26)24-16-10-13(7-6-12(16)2)19-23-17-11-14(21)8-9-18(17)25(19)3/h6-11,15H,4-5,22H2,1-3H3,(H,24,26)
InChIKeyKBDLBMHOZGWEOD-UHFFFAOYSA-N
XLogP3.75
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide 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

(2S)-2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]-4-methylpentanamide
CID 119891049
2-chloro-2-fluoro-N-[4-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]acetamide
CID 166427691
2-amino-N-[4-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]-2-(oxan-4-yl)acetamide
CID 120800894
2-amino-N-[4-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120800893
N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]piperidine-3-carboxamide;dihydrochloride
CID 119891004
(2S)-2-amino-N-(5-fluoro-2-methylphenyl)butanamide
CID 79025044
N-[4-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]-4-(methylamino)butanamide;dihydrochloride
CID 119890958
2-amino-4-(5-fluoro-1-methylbenzimidazol-2-yl)phenol
CID 136872083
(2R)-2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]pentanamide
CID 103794824
(2S)-2-amino-N-(5-fluoro-2-methylphenyl)-4-methylsulfanylbutanamide
CID 61149301
2-amino-N-(5-fluoro-2-methylphenyl)-4-methylsulfanylbutanamide
CID 76892783
2-amino-N-(4-fluoro-2-iodophenyl)pentanamide
CID 79766616

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide?
The IUPAC name of 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide (CID 119891017) is 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide.
What is the SMILES notation for 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide?
The canonical SMILES for 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide is CCCC(N)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C.
What is the InChIKey of 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide?
The InChIKey is KBDLBMHOZGWEOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN4O/c1-4-5-15(22)20(26)24-16-10-13(7-6-12(16)2)19-23-17-11-14(21)8-9-18(17)25(19)3/h6-11,15H,4-5,22H2,1-3H3,(H,24,26).
What are the key properties of 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide?
2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide has a molecular weight of 354.43 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylphenyl]pentanamide is sourced from PubChem (CID 119891017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).