1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine

C15H17F2N3O — CID 60854816

IUPAC1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine
SMILESNC1(c2ncc(-c3ccc(OC(F)F)cc3)[nH]2)CCCC1
InChIInChI=1S/C15H17F2N3O/c16-14(17)21-11-5-3-10(4-6-11)12-9-19-13(20-12)15(18)7-1-2-8-15/h3-6,9,14H,1-2,7-8,18H2,(H,19,20)
InChIKeyINAZTVNDXIDQEV-UHFFFAOYSA-N
MW293.32 g/mol
LogP3.41
Rot. Bonds4

About 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine

1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine (PubChem CID 60854816) has the molecular formula C15H17F2N3O and a molecular weight of 293.32 g/mol. Its IUPAC name is 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine
PubChem CID60854816
Molecular FormulaC15H17F2N3O
Molecular Weight293.32 g/mol
Exact Mass293.13
IUPAC Name1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine
SMILESNC1(c2ncc(-c3ccc(OC(F)F)cc3)[nH]2)CCCC1
InChIInChI=1S/C15H17F2N3O/c16-14(17)21-11-5-3-10(4-6-11)12-9-19-13(20-12)15(18)7-1-2-8-15/h3-6,9,14H,1-2,7-8,18H2,(H,19,20)
InChIKeyINAZTVNDXIDQEV-UHFFFAOYSA-N
XLogP3.41
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]-N-methylpropan-1-amine
CID 60841557
1-[4-[4-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]cyclopentan-1-amine;hydrochloride
CID 120558257
1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]-2-methylbutan-1-amine
CID 43651492
N-[2-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60852920
1-[5-(3-bromo-4-fluorophenyl)-1H-imidazol-2-yl]cyclopropan-1-amine
CID 65457295
1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine
CID 116883439
1-(5-naphthalen-1-yl-1H-imidazol-2-yl)cyclopentan-1-amine
CID 60854451
2-[2-(1-aminocyclobutyl)-1H-imidazol-5-yl]phenol
CID 105486642
3-[4-(difluoromethoxy)phenyl]oxan-3-amine
CID 154814534
1-(5-methyl-1H-imidazol-2-yl)cyclobutan-1-amine
CID 96733863
4-[4-(difluoromethoxy)phenyl]-5-(2,2-dimethylcyclopropyl)-1H-pyrazol-3-amine
CID 107001697
1-[5-(2-bromophenyl)-1H-imidazol-2-yl]cyclopropan-1-amine
CID 65459361

Frequently Asked Questions

What is the IUPAC name of 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine?
The IUPAC name of 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine (CID 60854816) is 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine.
What is the SMILES notation for 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine?
The canonical SMILES for 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine is NC1(c2ncc(-c3ccc(OC(F)F)cc3)[nH]2)CCCC1.
What is the InChIKey of 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine?
The InChIKey is INAZTVNDXIDQEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F2N3O/c16-14(17)21-11-5-3-10(4-6-11)12-9-19-13(20-12)15(18)7-1-2-8-15/h3-6,9,14H,1-2,7-8,18H2,(H,19,20).
What are the key properties of 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine?
1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine has a molecular weight of 293.32 g/mol, XLogP of 3.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[4-(difluoromethoxy)phenyl]-1H-imidazol-2-yl]cyclopentan-1-amine is sourced from PubChem (CID 60854816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).