N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide

C16H23N3O — CID 60597479

IUPACN-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide
SMILESCCCCC(=O)NC(C)c1nc2ccccc2n1CC
InChIInChI=1S/C16H23N3O/c1-4-6-11-15(20)17-12(3)16-18-13-9-7-8-10-14(13)19(16)5-2/h7-10,12H,4-6,11H2,1-3H3,(H,17,20)
InChIKeySRAKLMJTVRCNMI-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.42
Rot. Bonds6

About N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide

N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide (PubChem CID 60597479) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide.

Molecular Properties

Compound NameN-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide
PubChem CID60597479
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC NameN-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide
SMILESCCCCC(=O)NC(C)c1nc2ccccc2n1CC
InChIInChI=1S/C16H23N3O/c1-4-6-11-15(20)17-12(3)16-18-13-9-7-8-10-14(13)19(16)5-2/h7-10,12H,4-6,11H2,1-3H3,(H,17,20)
InChIKeySRAKLMJTVRCNMI-UHFFFAOYSA-N
XLogP3.42
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-(1-pentylbenzimidazol-2-yl)ethyl]butanamide
CID 7023923
4-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide
CID 120565069
N-[1-(1-undecylbenzimidazol-2-yl)ethyl]propanamide
CID 16968572
N-[1-(1-hexylbenzimidazol-2-yl)ethyl]-3-phenylpropanamide
CID 16970435
N-[(1R)-1-(1-propylbenzimidazol-2-yl)ethyl]propanamide
CID 751155
N-[1-(1-phenacylbenzimidazol-2-yl)ethyl]butanamide
CID 16968848
2-ethyl-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]butanamide
CID 16968998
N-[(1S)-1-[1-(2-methylpropyl)benzimidazol-2-yl]ethyl]propanamide
CID 751204
N-[(1R)-1-(1-pentylbenzimidazol-2-yl)ethyl]acetamide
CID 7023918
(2R)-N-[(1R)-1-(1-ethylbenzimidazol-2-yl)ethyl]-2-prop-2-enoxypropanamide
CID 95234012
3-amino-N-[1-(1-ethylbenzimidazol-2-yl)ethyl]-3-phenylpropanamide;dihydrochloride
CID 119953447
N-[(1R)-1-(1-ethylbenzimidazol-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 95234003

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide?
The IUPAC name of N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide (CID 60597479) is N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide.
What is the SMILES notation for N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide?
The canonical SMILES for N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide is CCCCC(=O)NC(C)c1nc2ccccc2n1CC.
What is the InChIKey of N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide?
The InChIKey is SRAKLMJTVRCNMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-4-6-11-15(20)17-12(3)16-18-13-9-7-8-10-14(13)19(16)5-2/h7-10,12H,4-6,11H2,1-3H3,(H,17,20).
What are the key properties of N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide?
N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide has a molecular weight of 273.38 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-ethylbenzimidazol-2-yl)ethyl]pentanamide is sourced from PubChem (CID 60597479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).