1-cycloheptyl-5-pyrrolidin-3-ylimidazole

C14H23N3 — CID 114717647

IUPAC1-cycloheptyl-5-pyrrolidin-3-ylimidazole
SMILESc1ncn(C2CCCCCC2)c1C1CCNC1
InChIInChI=1S/C14H23N3/c1-2-4-6-13(5-3-1)17-11-16-10-14(17)12-7-8-15-9-12/h10-13,15H,1-9H2
InChIKeyMYOPNLYQVAHZCS-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.86
Rot. Bonds2

About 1-cycloheptyl-5-pyrrolidin-3-ylimidazole

1-cycloheptyl-5-pyrrolidin-3-ylimidazole (PubChem CID 114717647) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-cycloheptyl-5-pyrrolidin-3-ylimidazole.

Molecular Properties

Compound Name1-cycloheptyl-5-pyrrolidin-3-ylimidazole
PubChem CID114717647
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name1-cycloheptyl-5-pyrrolidin-3-ylimidazole
SMILESc1ncn(C2CCCCCC2)c1C1CCNC1
InChIInChI=1S/C14H23N3/c1-2-4-6-13(5-3-1)17-11-16-10-14(17)12-7-8-15-9-12/h10-13,15H,1-9H2
InChIKeyMYOPNLYQVAHZCS-UHFFFAOYSA-N
XLogP2.86
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-pyrrolidin-3-ylimidazol-1-yl)cyclohexan-1-ol
CID 104966852
1-cyclopentyl-5-pyrrolidin-2-ylimidazole
CID 114703551
3-[5-(azetidin-3-yl)imidazol-1-yl]-9-methyl-9-azabicyclo[3.3.1]nonane
CID 114720708
1-(2-cyclobutylethyl)-5-pyrrolidin-3-ylimidazole
CID 114722227
3-[3-(1,2,3,4-tetrahydronaphthalen-2-yl)imidazol-4-yl]piperidine
CID 114705510
3-(5-piperidin-4-ylimidazol-1-yl)thiolane 1,1-dioxide
CID 114702845
1-cycloheptyl-4-pyrrolidin-3-ylpyrazole
CID 105493602
4-[3-(2,3-dihydro-1H-inden-2-yl)imidazol-4-yl]piperidine
CID 107854524
4-[3-(4-propylcyclohexyl)imidazol-4-yl]piperidine
CID 114704999
1-butyl-5-pyrrolidin-3-ylimidazole
CID 114716363
3-[3-(2,4-dimethylcyclohexyl)imidazol-4-yl]piperidine
CID 114706230
1-pentyl-5-pyrrolidin-3-ylimidazole
CID 114716240

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-5-pyrrolidin-3-ylimidazole?
The IUPAC name of 1-cycloheptyl-5-pyrrolidin-3-ylimidazole (CID 114717647) is 1-cycloheptyl-5-pyrrolidin-3-ylimidazole.
What is the SMILES notation for 1-cycloheptyl-5-pyrrolidin-3-ylimidazole?
The canonical SMILES for 1-cycloheptyl-5-pyrrolidin-3-ylimidazole is c1ncn(C2CCCCCC2)c1C1CCNC1.
What is the InChIKey of 1-cycloheptyl-5-pyrrolidin-3-ylimidazole?
The InChIKey is MYOPNLYQVAHZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-2-4-6-13(5-3-1)17-11-16-10-14(17)12-7-8-15-9-12/h10-13,15H,1-9H2.
What are the key properties of 1-cycloheptyl-5-pyrrolidin-3-ylimidazole?
1-cycloheptyl-5-pyrrolidin-3-ylimidazole has a molecular weight of 233.36 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-5-pyrrolidin-3-ylimidazole is sourced from PubChem (CID 114717647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).