4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole

C11H17N3 — CID 105445538

IUPAC4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole
SMILESCc1[nH]c(C2CCC2)nc1C1CNC1
InChIInChI=1S/C11H17N3/c1-7-10(9-5-12-6-9)14-11(13-7)8-3-2-4-8/h8-9,12H,2-6H2,1H3,(H,13,14)
InChIKeyLWLKCESGXAQDBJ-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.67
Rot. Bonds2

About 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole

4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole (PubChem CID 105445538) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole.

Molecular Properties

Compound Name4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole
PubChem CID105445538
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole
SMILESCc1[nH]c(C2CCC2)nc1C1CNC1
InChIInChI=1S/C11H17N3/c1-7-10(9-5-12-6-9)14-11(13-7)8-3-2-4-8/h8-9,12H,2-6H2,1H3,(H,13,14)
InChIKeyLWLKCESGXAQDBJ-UHFFFAOYSA-N
XLogP1.67
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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2-(azetidin-3-yl)-5-cyclobutyl-4-propan-2-yl-1H-imidazole
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3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine
CID 105492309
2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole
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2-cyclobutyl-6-methyl-1H-pyrimidine-4-thione
CID 106475707
2-cyclopropyl-4-ethyl-5-methyl-1H-imidazole
CID 123293833
4-[2-(azetidin-3-yl)-5-methyl-1H-imidazol-4-yl]phenol
CID 105486703
3-[4-(methoxymethyl)-5-methyl-1H-imidazol-2-yl]cyclohexan-1-amine
CID 82237881
2-cyclobutyl-5-methyl-1H-imidazo[4,5-b]pyridine
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Frequently Asked Questions

What is the IUPAC name of 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole?
The IUPAC name of 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole (CID 105445538) is 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole.
What is the SMILES notation for 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole?
The canonical SMILES for 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole is Cc1[nH]c(C2CCC2)nc1C1CNC1.
What is the InChIKey of 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole?
The InChIKey is LWLKCESGXAQDBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-7-10(9-5-12-6-9)14-11(13-7)8-3-2-4-8/h8-9,12H,2-6H2,1H3,(H,13,14).
What are the key properties of 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole?
4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole has a molecular weight of 191.28 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole is sourced from PubChem (CID 105445538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).