2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole

C14H23N3 — CID 105493632

IUPAC2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole
SMILESCC(C)c1nc(C2CNC2)[nH]c1C1CCCC1
InChIInChI=1S/C14H23N3/c1-9(2)12-13(10-5-3-4-6-10)17-14(16-12)11-7-15-8-11/h9-11,15H,3-8H2,1-2H3,(H,16,17)
InChIKeyYWLXOYGMDPZQIN-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.88
Rot. Bonds3

About 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole

2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole (PubChem CID 105493632) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole.

Molecular Properties

Compound Name2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole
PubChem CID105493632
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole
SMILESCC(C)c1nc(C2CNC2)[nH]c1C1CCCC1
InChIInChI=1S/C14H23N3/c1-9(2)12-13(10-5-3-4-6-10)17-14(16-12)11-7-15-8-11/h9-11,15H,3-8H2,1-2H3,(H,16,17)
InChIKeyYWLXOYGMDPZQIN-UHFFFAOYSA-N
XLogP2.88
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azetidin-3-yl)-5-cyclobutyl-4-propan-2-yl-1H-imidazole
CID 105474943
(2-cyclohexyl-4-propan-2-yl-1H-imidazol-5-yl)methanamine
CID 82373843
5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole
CID 105497006
4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole
CID 105445538
3-(4,5-dimethyl-1H-imidazol-2-yl)piperidine
CID 43650978
4-(1-chloro-2-methylpropyl)-2-cyclopropyl-5-methyl-1H-imidazole
CID 22412123
2-(azetidin-3-yl)-1,4,5,6-tetrahydrocyclopenta[d]imidazole
CID 115012866
2-cycloheptyl-4-propan-2-yl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114741398
2-(5-cyclopentyl-3-propan-2-yl-1H-pyrazol-4-yl)ethanamine
CID 121213122
5-bromo-6-cyclopentyl-2-propan-2-yl-1H-pyrimidine-4-thione
CID 106482090
5-methyl-4-propan-2-yl-2-pyrrolidin-2-yl-1H-imidazole
CID 82234810
5-bromo-4-chloro-2-cyclooctyl-6-propan-2-ylpyrimidine
CID 80603976

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole?
The IUPAC name of 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole (CID 105493632) is 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole.
What is the SMILES notation for 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole?
The canonical SMILES for 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole is CC(C)c1nc(C2CNC2)[nH]c1C1CCCC1.
What is the InChIKey of 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole?
The InChIKey is YWLXOYGMDPZQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-9(2)12-13(10-5-3-4-6-10)17-14(16-12)11-7-15-8-11/h9-11,15H,3-8H2,1-2H3,(H,16,17).
What are the key properties of 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole?
2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole has a molecular weight of 233.36 g/mol, XLogP of 2.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole is sourced from PubChem (CID 105493632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).