7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine

C14H17F2N3O — CID 155010197

IUPAC7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine
SMILESCNc1cn2cc(C3CCOCC3)nc2cc1C(F)F
InChIInChI=1S/C14H17F2N3O/c1-17-12-8-19-7-11(9-2-4-20-5-3-9)18-13(19)6-10(12)14(15)16/h6-9,14,17H,2-5H2,1H3
InChIKeyMJVHMTLRFGLZLP-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.21
Rot. Bonds3

About 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine

7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine (PubChem CID 155010197) has the molecular formula C14H17F2N3O and a molecular weight of 281.31 g/mol. Its IUPAC name is 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine
PubChem CID155010197
Molecular FormulaC14H17F2N3O
Molecular Weight281.31 g/mol
Exact Mass281.13
IUPAC Name7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine
SMILESCNc1cn2cc(C3CCOCC3)nc2cc1C(F)F
InChIInChI=1S/C14H17F2N3O/c1-17-12-8-19-7-11(9-2-4-20-5-3-9)18-13(19)6-10(12)14(15)16/h6-9,14,17H,2-5H2,1H3
InChIKeyMJVHMTLRFGLZLP-UHFFFAOYSA-N
XLogP3.21
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine (CID 155010197) is 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine is CNc1cn2cc(C3CCOCC3)nc2cc1C(F)F.
What is the InChIKey of 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine?
The InChIKey is MJVHMTLRFGLZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2N3O/c1-17-12-8-19-7-11(9-2-4-20-5-3-9)18-13(19)6-10(12)14(15)16/h6-9,14,17H,2-5H2,1H3.
What are the key properties of 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine?
7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine has a molecular weight of 281.31 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(difluoromethyl)-N-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 155010197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).