4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol

C21H19N3O — CID 7338091

IUPAC4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESCc1ccn2c(Nc3ccccc3C)c(-c3ccc(O)cc3)nc2c1
InChIInChI=1S/C21H19N3O/c1-14-11-12-24-19(13-14)23-20(16-7-9-17(25)10-8-16)21(24)22-18-6-4-3-5-15(18)2/h3-13,22,25H,1-2H3
InChIKeyGSPPIPJTKGQDKM-UHFFFAOYSA-N
MW329.40 g/mol
LogP5.07
Rot. Bonds3

About 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol

4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol (PubChem CID 7338091) has the molecular formula C21H19N3O and a molecular weight of 329.40 g/mol. Its IUPAC name is 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol.

Molecular Properties

Compound Name4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol
PubChem CID7338091
Molecular FormulaC21H19N3O
Molecular Weight329.40 g/mol
Exact Mass329.15
IUPAC Name4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESCc1ccn2c(Nc3ccccc3C)c(-c3ccc(O)cc3)nc2c1
InChIInChI=1S/C21H19N3O/c1-14-11-12-24-19(13-14)23-20(16-7-9-17(25)10-8-16)21(24)22-18-6-4-3-5-15(18)2/h3-13,22,25H,1-2H3
InChIKeyGSPPIPJTKGQDKM-UHFFFAOYSA-N
XLogP5.07
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.40
LogP ≤ 55.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol?
The IUPAC name of 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol (CID 7338091) is 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol.
What is the SMILES notation for 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol?
The canonical SMILES for 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol is Cc1ccn2c(Nc3ccccc3C)c(-c3ccc(O)cc3)nc2c1.
What is the InChIKey of 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol?
The InChIKey is GSPPIPJTKGQDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O/c1-14-11-12-24-19(13-14)23-20(16-7-9-17(25)10-8-16)21(24)22-18-6-4-3-5-15(18)2/h3-13,22,25H,1-2H3.
What are the key properties of 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol?
4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol has a molecular weight of 329.40 g/mol, XLogP of 5.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-methyl-3-(2-methylanilino)imidazo[1,2-a]pyridin-2-yl]phenol is sourced from PubChem (CID 7338091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).