N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide

C19H19F2N3O — CID 53131277

IUPACN-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide
SMILESCCCc1nc2ccc(CCC(=O)Nc3cc(F)cc(F)c3)cc2[nH]1
InChIInChI=1S/C19H19F2N3O/c1-2-3-18-23-16-6-4-12(8-17(16)24-18)5-7-19(25)22-15-10-13(20)9-14(21)11-15/h4,6,8-11H,2-3,5,7H2,1H3,(H,22,25)(H,23,24)
InChIKeyJNUDLVKNHKTFLA-UHFFFAOYSA-N
MW343.38 g/mol
LogP4.36
Rot. Bonds6

About N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide

N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide (PubChem CID 53131277) has the molecular formula C19H19F2N3O and a molecular weight of 343.38 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide
PubChem CID53131277
Molecular FormulaC19H19F2N3O
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide
SMILESCCCc1nc2ccc(CCC(=O)Nc3cc(F)cc(F)c3)cc2[nH]1
InChIInChI=1S/C19H19F2N3O/c1-2-3-18-23-16-6-4-12(8-17(16)24-18)5-7-19(25)22-15-10-13(20)9-14(21)11-15/h4,6,8-11H,2-3,5,7H2,1H3,(H,22,25)(H,23,24)
InChIKeyJNUDLVKNHKTFLA-UHFFFAOYSA-N
XLogP4.36
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dimethoxyphenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide
CID 53131237
N-(2,5-dimethylphenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide
CID 53131255
N-(4-fluorophenyl)-2-[2-[4-(propanoylamino)phenyl]ethyl]-3H-benzimidazole-5-carboxamide
CID 50789623
N-(3,5-difluorophenyl)butanamide
CID 17271988
2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide
CID 110772765
1-(3,5-dimethylphenyl)-3-[2-[2-(4-fluorophenyl)ethyl]-3H-benzimidazol-5-yl]urea
CID 155114131
3-(6-ethyl-1H-benzimidazol-2-yl)propanoic acid
CID 79017254
3-(4-fluorophenyl)-N-[(2-methyl-3H-benzimidazol-5-yl)methyl]propanamide
CID 110785648
methyl 3-[2-(chloromethyl)-3H-benzimidazol-5-yl]propanoate
CID 122513917
2-amino-N-(2-butyl-3H-benzimidazol-5-yl)acetamide;dihydrochloride
CID 119854415
4-(6-ethyl-1H-benzimidazol-2-yl)butanoic acid
CID 80502897
N-(2-ethyl-3H-benzimidazol-5-yl)-3-(methylamino)propanamide
CID 96675307

Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide?
The IUPAC name of N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide (CID 53131277) is N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide.
What is the SMILES notation for N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide?
The canonical SMILES for N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide is CCCc1nc2ccc(CCC(=O)Nc3cc(F)cc(F)c3)cc2[nH]1.
What is the InChIKey of N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide?
The InChIKey is JNUDLVKNHKTFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N3O/c1-2-3-18-23-16-6-4-12(8-17(16)24-18)5-7-19(25)22-15-10-13(20)9-14(21)11-15/h4,6,8-11H,2-3,5,7H2,1H3,(H,22,25)(H,23,24).
What are the key properties of N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide?
N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide has a molecular weight of 343.38 g/mol, XLogP of 4.36, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-3-(2-propyl-3H-benzimidazol-5-yl)propanamide is sourced from PubChem (CID 53131277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).