1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile

C12H15N3 — CID 116881927

IUPAC1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile
SMILESN#CC1(c2ncc(C3CCCC3)[nH]2)CC1
InChIInChI=1S/C12H15N3/c13-8-12(5-6-12)11-14-7-10(15-11)9-3-1-2-4-9/h7,9H,1-6H2,(H,14,15)
InChIKeyFFJZZZIOHZEJJD-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.62
Rot. Bonds2

About 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile

1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile (PubChem CID 116881927) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile.

Molecular Properties

Compound Name1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile
PubChem CID116881927
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile
SMILESN#CC1(c2ncc(C3CCCC3)[nH]2)CC1
InChIInChI=1S/C12H15N3/c13-8-12(5-6-12)11-14-7-10(15-11)9-3-1-2-4-9/h7,9H,1-6H2,(H,14,15)
InChIKeyFFJZZZIOHZEJJD-UHFFFAOYSA-N
XLogP2.62
TPSA52.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile?
The IUPAC name of 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile (CID 116881927) is 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile.
What is the SMILES notation for 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile?
The canonical SMILES for 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile is N#CC1(c2ncc(C3CCCC3)[nH]2)CC1.
What is the InChIKey of 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile?
The InChIKey is FFJZZZIOHZEJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c13-8-12(5-6-12)11-14-7-10(15-11)9-3-1-2-4-9/h7,9H,1-6H2,(H,14,15).
What are the key properties of 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile?
1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile has a molecular weight of 201.27 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopentyl-1H-imidazol-2-yl)cyclopropane-1-carbonitrile is sourced from PubChem (CID 116881927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).