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

C19H20BrN3O — CID 3784759

IUPAC2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESOc1ccccc1-c1nc2ccc(Br)cn2c1NC1CCCCC1
InChIInChI=1S/C19H20BrN3O/c20-13-10-11-17-22-18(15-8-4-5-9-16(15)24)19(23(17)12-13)21-14-6-2-1-3-7-14/h4-5,8-12,14,21,24H,1-3,6-7H2
InChIKeyCIGBZIYMJPRPQZ-UHFFFAOYSA-N
MW386.29 g/mol
LogP5.21
Rot. Bonds3

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

2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol (PubChem CID 3784759) has the molecular formula C19H20BrN3O and a molecular weight of 386.29 g/mol. Its IUPAC name is 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol.

Molecular Properties

Compound Name2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol
PubChem CID3784759
Molecular FormulaC19H20BrN3O
Molecular Weight386.29 g/mol
Exact Mass385.08
IUPAC Name2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESOc1ccccc1-c1nc2ccc(Br)cn2c1NC1CCCCC1
InChIInChI=1S/C19H20BrN3O/c20-13-10-11-17-22-18(15-8-4-5-9-16(15)24)19(23(17)12-13)21-14-6-2-1-3-7-14/h4-5,8-12,14,21,24H,1-3,6-7H2
InChIKeyCIGBZIYMJPRPQZ-UHFFFAOYSA-N
XLogP5.21
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.29
LogP ≤ 55.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Antiproliferative agent-14
CID 86280647
2-({[5-(3-bromophenyl)-1-methyl-1H-imidazol-2-yl]amino}methyl)phenol
CID 1096475
2-{3-[(2,6-Dimethylphenyl)amino]imidazo[1,2-a]pyrimidin-2-yl}phenol
CID 15990343
4-Imidazo[1,2-a]pyridin-2-yl-phenol
CID 16682232
4-[3-(Cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol
CID 856590
4-[6-Bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol
CID 1154287
EAPB-0503 metabolite M'5
CID 44224744
4-[3-[4-(Dimethylamino)phenyl]imidazo[1,2-a]pyrazin-6-yl]phenol
CID 117769710
N2-(4-amino-cyclohexyl)-9-cyclopentyl-N6-[6-(2-hydroxy-phenyl)-pyridin-3-ylmethyl]-9H-purine-2,6-diamine
CID 136219283
4-(6-Phenylimidazo[1,2-a]pyrazin-3-yl)phenol
CID 141381328
2-[3-[(5-bromo-1H-indol-2-yl)methyl]imidazol-4-yl]phenol
CID 142619907
2-[3-[(5-bromo-1H-indol-2-yl)methyl]imidazol-4-yl]-4-fluorophenol
CID 142619921

Frequently Asked Questions

What is the IUPAC name of 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The IUPAC name of 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol (CID 3784759) is 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol.
What is the SMILES notation for 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The canonical SMILES for 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol is Oc1ccccc1-c1nc2ccc(Br)cn2c1NC1CCCCC1.
What is the InChIKey of 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The InChIKey is CIGBZIYMJPRPQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20BrN3O/c20-13-10-11-17-22-18(15-8-4-5-9-16(15)24)19(23(17)12-13)21-14-6-2-1-3-7-14/h4-5,8-12,14,21,24H,1-3,6-7H2.
What are the key properties of 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol has a molecular weight of 386.29 g/mol, XLogP of 5.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol is sourced from PubChem (CID 3784759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).