2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol

C20H23N3O — CID 856589

IUPAC2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol
SMILESCc1ccc2nc(-c3ccccc3O)c(NC3CCCCC3)n2c1
InChIInChI=1S/C20H23N3O/c1-14-11-12-18-22-19(16-9-5-6-10-17(16)24)20(23(18)13-14)21-15-7-3-2-4-8-15/h5-6,9-13,15,21,24H,2-4,7-8H2,1H3
InChIKeyXHXUSKGTMYPQMC-UHFFFAOYSA-N
MW321.42 g/mol
LogP4.76
Rot. Bonds3

About 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol

2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol (PubChem CID 856589) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol.

Molecular Properties

Compound Name2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol
PubChem CID856589
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol
SMILESCc1ccc2nc(-c3ccccc3O)c(NC3CCCCC3)n2c1
InChIInChI=1S/C20H23N3O/c1-14-11-12-18-22-19(16-9-5-6-10-17(16)24)20(23(18)13-14)21-15-7-3-2-4-8-15/h5-6,9-13,15,21,24H,2-4,7-8H2,1H3
InChIKeyXHXUSKGTMYPQMC-UHFFFAOYSA-N
XLogP4.76
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 54.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol?
The IUPAC name of 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol (CID 856589) is 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol.
What is the SMILES notation for 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol?
The canonical SMILES for 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol is Cc1ccc2nc(-c3ccccc3O)c(NC3CCCCC3)n2c1.
What is the InChIKey of 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol?
The InChIKey is XHXUSKGTMYPQMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c1-14-11-12-18-22-19(16-9-5-6-10-17(16)24)20(23(18)13-14)21-15-7-3-2-4-8-15/h5-6,9-13,15,21,24H,2-4,7-8H2,1H3.
What are the key properties of 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol?
2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol has a molecular weight of 321.42 g/mol, XLogP of 4.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol is sourced from PubChem (CID 856589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).