N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide

C15H19N3O — CID 115602213

IUPACN-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide
SMILESCCc1nc2ccccc2n1CCC(=O)NC1CC1
InChIInChI=1S/C15H19N3O/c1-2-14-17-12-5-3-4-6-13(12)18(14)10-9-15(19)16-11-7-8-11/h3-6,11H,2,7-10H2,1H3,(H,16,19)
InChIKeyNHGDTSXGTLXTRC-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.27
Rot. Bonds5

About N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide

N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide (PubChem CID 115602213) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide
PubChem CID115602213
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide
SMILESCCc1nc2ccccc2n1CCC(=O)NC1CC1
InChIInChI=1S/C15H19N3O/c1-2-14-17-12-5-3-4-6-13(12)18(14)10-9-15(19)16-11-7-8-11/h3-6,11H,2,7-10H2,1H3,(H,16,19)
InChIKeyNHGDTSXGTLXTRC-UHFFFAOYSA-N
XLogP2.27
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 115588669
3-(2-ethylbenzimidazol-1-yl)-N-methylsulfonylpropanamide
CID 154814647
3-(2-ethylbenzimidazol-1-yl)propanoic acid chloride
CID 53347020
2-(2-ethylbenzimidazol-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 51219854
3-(2-ethylbenzimidazol-1-yl)-N-(oxolan-3-ylmethyl)propanamide
CID 119068190
N-[[(3S)-1,1-dioxothiolan-3-yl]methyl]-3-(2-ethylbenzimidazol-1-yl)propanamide
CID 99961864
3-(2-ethylbenzimidazol-1-yl)-N-[(1R,2R,3R)-2-hydroxy-3-(2-methylimidazol-1-yl)cyclopentyl]propanamide
CID 110163698
N-[3-(2-ethylbenzimidazol-1-yl)propyl]cyclopropanamine
CID 63106717
1,7-bis(2-ethylbenzimidazol-1-yl)heptan-4-one
CID 139073818
3-(2-ethylbenzimidazol-1-yl)-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]propanamide
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N-cyclopropyl-2-(2-methylbenzimidazol-1-yl)acetamide
CID 7755737

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide?
The IUPAC name of N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide (CID 115602213) is N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide is CCc1nc2ccccc2n1CCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide?
The InChIKey is NHGDTSXGTLXTRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-2-14-17-12-5-3-4-6-13(12)18(14)10-9-15(19)16-11-7-8-11/h3-6,11H,2,7-10H2,1H3,(H,16,19).
What are the key properties of N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide?
N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide has a molecular weight of 257.34 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(2-ethylbenzimidazol-1-yl)propanamide is sourced from PubChem (CID 115602213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).