5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine

C13H14F2N4O — CID 142298661

IUPAC5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine
SMILESNc1ncc(-c2cnc(C3CCC3)[nH]2)cc1OC(F)F
InChIInChI=1S/C13H14F2N4O/c14-13(15)20-10-4-8(5-17-11(10)16)9-6-18-12(19-9)7-2-1-3-7/h4-7,13H,1-3H2,(H2,16,17)(H,18,19)
InChIKeyDCKXULZBNCZYLC-UHFFFAOYSA-N
MW280.28 g/mol
LogP2.92
Rot. Bonds4

About 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine

5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine (PubChem CID 142298661) has the molecular formula C13H14F2N4O and a molecular weight of 280.28 g/mol. Its IUPAC name is 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine.

Molecular Properties

Compound Name5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine
PubChem CID142298661
Molecular FormulaC13H14F2N4O
Molecular Weight280.28 g/mol
Exact Mass280.11
IUPAC Name5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine
SMILESNc1ncc(-c2cnc(C3CCC3)[nH]2)cc1OC(F)F
InChIInChI=1S/C13H14F2N4O/c14-13(15)20-10-4-8(5-17-11(10)16)9-6-18-12(19-9)7-2-1-3-7/h4-7,13H,1-3H2,(H2,16,17)(H,18,19)
InChIKeyDCKXULZBNCZYLC-UHFFFAOYSA-N
XLogP2.92
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.28
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-cyclopropyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine;(5S)-3-(oxan-4-yl)-3-azabicyclo[3.1.0]hexane
CID 142298581
5-(2-cyclopropyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine;3-methyl-1-(2,2,2-trifluoroethyl)pyrrolidine
CID 142298556
5-(2-cyclopropyl-1H-imidazol-5-yl)-3-methylpyridin-2-amine
CID 142298664
4-(2-cyclobutyl-1H-imidazol-5-yl)benzene-1,2-diol
CID 115037686
2-cyclopropyl-5-(4-fluorophenyl)-1H-imidazole
CID 90241425
3-(difluoromethoxy)-5-(1-propan-2-ylazet-1-ium-2-yl)pyridin-2-amine
CID 123982246
3-(2-cyclopentyl-1H-imidazol-5-yl)phenol
CID 115036762
5-[6-(azetidin-1-yl)-2-(3-fluoropyrrolidin-1-yl)pyrimidin-4-yl]-3-(difluoromethoxy)pyridin-2-amine
CID 123851386
4-[5-(3-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-amine
CID 54928275
2-[[4-(2-cyclopentyl-1H-imidazol-5-yl)-2-methoxyphenoxy]methyl]-5-(trifluoromethyl)pyridine
CID 146407301
3-[3-[2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-6-cyclopropyl-4-pyridinyl]azetidin-1-yl]propan-1-ol
CID 134505321
[6-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-2-(2,2-difluorocyclopropyl)pyrimidin-4-yl]methanethiol
CID 134505303

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine?
The IUPAC name of 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine (CID 142298661) is 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine.
What is the SMILES notation for 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine?
The canonical SMILES for 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine is Nc1ncc(-c2cnc(C3CCC3)[nH]2)cc1OC(F)F.
What is the InChIKey of 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine?
The InChIKey is DCKXULZBNCZYLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14F2N4O/c14-13(15)20-10-4-8(5-17-11(10)16)9-6-18-12(19-9)7-2-1-3-7/h4-7,13H,1-3H2,(H2,16,17)(H,18,19).
What are the key properties of 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine?
5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine has a molecular weight of 280.28 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclobutyl-1H-imidazol-5-yl)-3-(difluoromethoxy)pyridin-2-amine is sourced from PubChem (CID 142298661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).