1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol

C23H23N3O — CID 138535818

IUPAC1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc2ccccn2c1NC1CCCCC1
InChIInChI=1S/C23H23N3O/c27-19-14-13-16-8-4-5-11-18(16)21(19)22-23(24-17-9-2-1-3-10-17)26-15-7-6-12-20(26)25-22/h4-8,11-15,17,24,27H,1-3,9-10H2
InChIKeyGCGTUVGCUSOIMQ-UHFFFAOYSA-N
MW357.46 g/mol
LogP5.60
Rot. Bonds3

About 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol

1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol (PubChem CID 138535818) has the molecular formula C23H23N3O and a molecular weight of 357.46 g/mol. Its IUPAC name is 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol
PubChem CID138535818
Molecular FormulaC23H23N3O
Molecular Weight357.46 g/mol
Exact Mass357.18
IUPAC Name1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc2ccccn2c1NC1CCCCC1
InChIInChI=1S/C23H23N3O/c27-19-14-13-16-8-4-5-11-18(16)21(19)22-23(24-17-9-2-1-3-10-17)26-15-7-6-12-20(26)25-22/h4-8,11-15,17,24,27H,1-3,9-10H2
InChIKeyGCGTUVGCUSOIMQ-UHFFFAOYSA-N
XLogP5.60
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.46
LogP ≤ 55.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol?
The IUPAC name of 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol (CID 138535818) is 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol.
What is the SMILES notation for 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol?
The canonical SMILES for 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol is Oc1ccc2ccccc2c1-c1nc2ccccn2c1NC1CCCCC1.
What is the InChIKey of 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol?
The InChIKey is GCGTUVGCUSOIMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O/c27-19-14-13-16-8-4-5-11-18(16)21(19)22-23(24-17-9-2-1-3-10-17)26-15-7-6-12-20(26)25-22/h4-8,11-15,17,24,27H,1-3,9-10H2.
What are the key properties of 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol?
1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol has a molecular weight of 357.46 g/mol, XLogP of 5.60, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]naphthalen-2-ol is sourced from PubChem (CID 138535818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).