2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine

C10H15F2N3O — CID 106938917

IUPAC2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine
SMILESNC1CCCC1OCc1nccn1C(F)F
InChIInChI=1S/C10H15F2N3O/c11-10(12)15-5-4-14-9(15)6-16-8-3-1-2-7(8)13/h4-5,7-8,10H,1-3,6,13H2
InChIKeyPBGINILVBKCUJG-UHFFFAOYSA-N
MW231.25 g/mol
LogP1.67
Rot. Bonds4

About 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine

2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine (PubChem CID 106938917) has the molecular formula C10H15F2N3O and a molecular weight of 231.25 g/mol. Its IUPAC name is 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine.

Molecular Properties

Compound Name2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine
PubChem CID106938917
Molecular FormulaC10H15F2N3O
Molecular Weight231.25 g/mol
Exact Mass231.12
IUPAC Name2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine
SMILESNC1CCCC1OCc1nccn1C(F)F
InChIInChI=1S/C10H15F2N3O/c11-10(12)15-5-4-14-9(15)6-16-8-3-1-2-7(8)13/h4-5,7-8,10H,1-3,6,13H2
InChIKeyPBGINILVBKCUJG-UHFFFAOYSA-N
XLogP1.67
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine?
The IUPAC name of 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine (CID 106938917) is 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine.
What is the SMILES notation for 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine?
The canonical SMILES for 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine is NC1CCCC1OCc1nccn1C(F)F.
What is the InChIKey of 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine?
The InChIKey is PBGINILVBKCUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F2N3O/c11-10(12)15-5-4-14-9(15)6-16-8-3-1-2-7(8)13/h4-5,7-8,10H,1-3,6,13H2.
What are the key properties of 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine?
2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine has a molecular weight of 231.25 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]cyclopentan-1-amine is sourced from PubChem (CID 106938917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).