N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide

C24H21F3N6O2 — CID 90456396

IUPACN-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide
SMILESCc1ncc(NC(=O)c2cc(C(F)(F)F)ccn2)cc1-c1cc(N2CCOCC2)c2nccn2c1
InChIInChI=1S/C24H21F3N6O2/c1-15-19(16-10-21(32-6-8-35-9-7-32)22-29-4-5-33(22)14-16)12-18(13-30-15)31-23(34)20-11-17(2-3-28-20)24(25,26)27/h2-5,10-14H,6-9H2,1H3,(H,31,34)
InChIKeyIXHQJQAHYPCKSY-UHFFFAOYSA-N
MW482.47 g/mol
LogP4.21
Rot. Bonds4

About N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide

N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 90456396) has the molecular formula C24H21F3N6O2 and a molecular weight of 482.47 g/mol. Its IUPAC name is N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID90456396
Molecular FormulaC24H21F3N6O2
Molecular Weight482.47 g/mol
Exact Mass482.17
IUPAC NameN-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide
SMILESCc1ncc(NC(=O)c2cc(C(F)(F)F)ccn2)cc1-c1cc(N2CCOCC2)c2nccn2c1
InChIInChI=1S/C24H21F3N6O2/c1-15-19(16-10-21(32-6-8-35-9-7-32)22-29-4-5-33(22)14-16)12-18(13-30-15)31-23(34)20-11-17(2-3-28-20)24(25,26)27/h2-5,10-14H,6-9H2,1H3,(H,31,34)
InChIKeyIXHQJQAHYPCKSY-UHFFFAOYSA-N
XLogP4.21
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.47
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide (CID 90456396) is N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide is Cc1ncc(NC(=O)c2cc(C(F)(F)F)ccn2)cc1-c1cc(N2CCOCC2)c2nccn2c1.
What is the InChIKey of N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is IXHQJQAHYPCKSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21F3N6O2/c1-15-19(16-10-21(32-6-8-35-9-7-32)22-29-4-5-33(22)14-16)12-18(13-30-15)31-23(34)20-11-17(2-3-28-20)24(25,26)27/h2-5,10-14H,6-9H2,1H3,(H,31,34).
What are the key properties of N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide?
N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 482.47 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 90456396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).