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

C20H20F2N4O2 — CID 154655916

IUPACN-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2cn3cc(C4CCOCC4)nc3cc2C(F)F)n1
InChIInChI=1S/C20H20F2N4O2/c1-12-3-2-4-15(23-12)20(27)25-17-11-26-10-16(13-5-7-28-8-6-13)24-18(26)9-14(17)19(21)22/h2-4,9-11,13,19H,5-8H2,1H3,(H,25,27)
InChIKeyDVUWVDDNCDREJG-UHFFFAOYSA-N
MW386.40 g/mol
LogP4.12
Rot. Bonds4

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

N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide (PubChem CID 154655916) has the molecular formula C20H20F2N4O2 and a molecular weight of 386.40 g/mol. Its IUPAC name is N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
PubChem CID154655916
Molecular FormulaC20H20F2N4O2
Molecular Weight386.40 g/mol
Exact Mass386.16
IUPAC NameN-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2cn3cc(C4CCOCC4)nc3cc2C(F)F)n1
InChIInChI=1S/C20H20F2N4O2/c1-12-3-2-4-15(23-12)20(27)25-17-11-26-10-16(13-5-7-28-8-6-13)24-18(26)9-14(17)19(21)22/h2-4,9-11,13,19H,5-8H2,1H3,(H,25,27)
InChIKeyDVUWVDDNCDREJG-UHFFFAOYSA-N
XLogP4.12
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.40
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide?
The IUPAC name of N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide (CID 154655916) is N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)Nc2cn3cc(C4CCOCC4)nc3cc2C(F)F)n1.
What is the InChIKey of N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide?
The InChIKey is DVUWVDDNCDREJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N4O2/c1-12-3-2-4-15(23-12)20(27)25-17-11-26-10-16(13-5-7-28-8-6-13)24-18(26)9-14(17)19(21)22/h2-4,9-11,13,19H,5-8H2,1H3,(H,25,27).
What are the key properties of N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide?
N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide has a molecular weight of 386.40 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(difluoromethyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 154655916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).