4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine

C19H14F3N5 — CID 44820214

IUPAC4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
SMILESCc1nc2ccccn2c1-c1ccnc(Nc2ccc(C(F)(F)F)cc2)n1
InChIInChI=1S/C19H14F3N5/c1-12-17(27-11-3-2-4-16(27)24-12)15-9-10-23-18(26-15)25-14-7-5-13(6-8-14)19(20,21)22/h2-11H,1H3,(H,23,25,26)
InChIKeyDWJULNFNGALOCE-UHFFFAOYSA-N
MW369.35 g/mol
LogP4.86
Rot. Bonds3

About 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine

4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine (PubChem CID 44820214) has the molecular formula C19H14F3N5 and a molecular weight of 369.35 g/mol. Its IUPAC name is 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
PubChem CID44820214
Molecular FormulaC19H14F3N5
Molecular Weight369.35 g/mol
Exact Mass369.12
IUPAC Name4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
SMILESCc1nc2ccccn2c1-c1ccnc(Nc2ccc(C(F)(F)F)cc2)n1
InChIInChI=1S/C19H14F3N5/c1-12-17(27-11-3-2-4-16(27)24-12)15-9-10-23-18(26-15)25-14-7-5-13(6-8-14)19(20,21)22/h2-11H,1H3,(H,23,25,26)
InChIKeyDWJULNFNGALOCE-UHFFFAOYSA-N
XLogP4.86
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.35
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine?
The IUPAC name of 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine (CID 44820214) is 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine.
What is the SMILES notation for 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine?
The canonical SMILES for 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine is Cc1nc2ccccn2c1-c1ccnc(Nc2ccc(C(F)(F)F)cc2)n1.
What is the InChIKey of 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine?
The InChIKey is DWJULNFNGALOCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N5/c1-12-17(27-11-3-2-4-16(27)24-12)15-9-10-23-18(26-15)25-14-7-5-13(6-8-14)19(20,21)22/h2-11H,1H3,(H,23,25,26).
What are the key properties of 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine?
4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine has a molecular weight of 369.35 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine is sourced from PubChem (CID 44820214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).