N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide

C13H19N3O — CID 91628973

IUPACN-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide
SMILESO=C(NCCn1ccnc1C1CC1)C1CCC1
InChIInChI=1S/C13H19N3O/c17-13(11-2-1-3-11)15-7-9-16-8-6-14-12(16)10-4-5-10/h6,8,10-11H,1-5,7,9H2,(H,15,17)
InChIKeyUIFAOMJDMOYILJ-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.68
Rot. Bonds5

About N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide

N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide (PubChem CID 91628973) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide
PubChem CID91628973
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide
SMILESO=C(NCCn1ccnc1C1CC1)C1CCC1
InChIInChI=1S/C13H19N3O/c17-13(11-2-1-3-11)15-7-9-16-8-6-14-12(16)10-4-5-10/h6,8,10-11H,1-5,7,9H2,(H,15,17)
InChIKeyUIFAOMJDMOYILJ-UHFFFAOYSA-N
XLogP1.68
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclohexyl-N-(3-imidazolylpropyl)carboxamide
CID 3425823
N,2-dibutylimidazole-1-carboxamide
CID 44306016
N-(2-{3-[1-(cyclobutylmethyl)-1H-imidazol-2-yl]-1-piperidinyl}-2-oxoethyl)urea
CID 72904808
1-(cyclobutylcarbonyl)-N-methyl-N-[3-(1-methyl-1H-imidazol-2-yl)propyl]-4-piperidinecarboxamide
CID 72924602
N-(1-ethylimidazol-4-yl)cyclobutanecarboxamide
CID 137640756
rac-(5R,6S)-5-(aminomethyl)-1-cyclopropyl-6-(1-methyl-1H-imidazol-2-yl)piperidin-2-one
CID 125424778
1-(cyclopropylcarbonyl)-N-[2-methyl-1-(1-methyl-1H-imidazol-2-yl)propyl]-4-piperidinecarboxamide
CID 72842055
1-(cyclobutylcarbonyl)-N-[2-(2-ethyl-1H-imidazol-1-yl)ethyl]-4-piperidinecarboxamide
CID 72851366
N-[2-(5-Methyl-1-propyl-1H-imidazol-2-YL)ethyl]cyclobutanecarboxamide
CID 124078803
N-(3-(1H-Imidazol-1-yl)propyl)hexanamide
CID 4188384
N-[3-(1H-imidazol-1-yl)propyl]cyclobutanecarboxamide
CID 2970732
N-(3-imidazol-1-ylpropyl)cyclopentanecarboxamide
CID 4108958

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide?
The IUPAC name of N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide (CID 91628973) is N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide?
The canonical SMILES for N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide is O=C(NCCn1ccnc1C1CC1)C1CCC1.
What is the InChIKey of N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide?
The InChIKey is UIFAOMJDMOYILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c17-13(11-2-1-3-11)15-7-9-16-8-6-14-12(16)10-4-5-10/h6,8,10-11H,1-5,7,9H2,(H,15,17).
What are the key properties of N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide?
N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-cyclopropylimidazol-1-yl)ethyl]cyclobutanecarboxamide is sourced from PubChem (CID 91628973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).