3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole

C10H16N2 — CID 19417604

IUPAC3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole
SMILESCCCCn1cnc2c1CCC2
InChIInChI=1S/C10H16N2/c1-2-3-7-12-8-11-9-5-4-6-10(9)12/h8H,2-7H2,1H3
InChIKeyZILUMMBCSILDCF-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.17
Rot. Bonds3

About 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole

3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole (PubChem CID 19417604) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole.

Molecular Properties

Compound Name3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole
PubChem CID19417604
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole
SMILESCCCCn1cnc2c1CCC2
InChIInChI=1S/C10H16N2/c1-2-3-7-12-8-11-9-5-4-6-10(9)12/h8H,2-7H2,1H3
InChIKeyZILUMMBCSILDCF-UHFFFAOYSA-N
XLogP2.17
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole?
The IUPAC name of 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole (CID 19417604) is 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole.
What is the SMILES notation for 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole?
The canonical SMILES for 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole is CCCCn1cnc2c1CCC2.
What is the InChIKey of 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole?
The InChIKey is ZILUMMBCSILDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-2-3-7-12-8-11-9-5-4-6-10(9)12/h8H,2-7H2,1H3.
What are the key properties of 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole?
3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole has a molecular weight of 164.25 g/mol, XLogP of 2.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-5,6-dihydro-4H-cyclopenta[d]imidazole is sourced from PubChem (CID 19417604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).