2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide

C20H31N3O — CID 16974700

IUPAC2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide
SMILESCCC(C)Cn1c(CCNC(=O)C(CC)CC)nc2ccccc21
InChIInChI=1S/C20H31N3O/c1-5-15(4)14-23-18-11-9-8-10-17(18)22-19(23)12-13-21-20(24)16(6-2)7-3/h8-11,15-16H,5-7,12-14H2,1-4H3,(H,21,24)
InChIKeyAAESBGQVORDXAX-UHFFFAOYSA-N
MW329.49 g/mol
LogP4.18
Rot. Bonds9

About 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide

2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide (PubChem CID 16974700) has the molecular formula C20H31N3O and a molecular weight of 329.49 g/mol. Its IUPAC name is 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide
PubChem CID16974700
Molecular FormulaC20H31N3O
Molecular Weight329.49 g/mol
Exact Mass329.25
IUPAC Name2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide
SMILESCCC(C)Cn1c(CCNC(=O)C(CC)CC)nc2ccccc21
InChIInChI=1S/C20H31N3O/c1-5-15(4)14-23-18-11-9-8-10-17(18)22-19(23)12-13-21-20(24)16(6-2)7-3/h8-11,15-16H,5-7,12-14H2,1-4H3,(H,21,24)
InChIKeyAAESBGQVORDXAX-UHFFFAOYSA-N
XLogP4.18
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.49
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]benzamide
CID 16976035
N-[2-(1-benzylbenzimidazol-2-yl)ethyl]-2-ethylbutanamide
CID 16974712
N-[2-[1-[2-[bis(2-methylpropyl)amino]-2-oxoethyl]benzimidazol-2-yl]ethyl]-2-ethylbutanamide
CID 16974826
N-[3-[1-(2-methylbutyl)benzimidazol-2-yl]propyl]-2-(2-methylphenyl)acetamide
CID 16985028
N-[2-[1-[(2,6-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]-2-ethylbutanamide
CID 16974719
4-methyl-N-[3-[1-(2-methylbutyl)benzimidazol-2-yl]propyl]benzamide
CID 16984255
2-ethyl-N-[2-[1-[(E)-3-phenylprop-2-enyl]benzimidazol-2-yl]ethyl]butanamide
CID 16974740
2,4-dimethyl-N-[3-[1-(2-methylbutyl)benzimidazol-2-yl]propyl]benzamide
CID 16982511
3-[1-(2-methylbutyl)benzimidazol-2-yl]propan-1-ol
CID 2945571
(2R)-2-amino-N-[2-(1-ethylbenzimidazol-2-yl)ethyl]propanamide
CID 119866308
2-ethyl-N-[2-[1-[2-(4-methylphenoxy)ethyl]benzimidazol-2-yl]ethyl]butanamide
CID 16974759
2-ethyl-N-[2-[1-[2-(2-methylphenoxy)ethyl]benzimidazol-2-yl]ethyl]butanamide
CID 16974742

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide?
The IUPAC name of 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide (CID 16974700) is 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide?
The canonical SMILES for 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide is CCC(C)Cn1c(CCNC(=O)C(CC)CC)nc2ccccc21.
What is the InChIKey of 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide?
The InChIKey is AAESBGQVORDXAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O/c1-5-15(4)14-23-18-11-9-8-10-17(18)22-19(23)12-13-21-20(24)16(6-2)7-3/h8-11,15-16H,5-7,12-14H2,1-4H3,(H,21,24).
What are the key properties of 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide?
2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide has a molecular weight of 329.49 g/mol, XLogP of 4.18, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-[1-(2-methylbutyl)benzimidazol-2-yl]ethyl]butanamide is sourced from PubChem (CID 16974700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).