[8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol

C18H18Cl2N2O2 — CID 131737642

IUPAC[8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol
SMILESCc1nc2c(OCCCc3ccc(Cl)cc3Cl)cccn2c1CO
InChIInChI=1S/C18H18Cl2N2O2/c1-12-16(11-23)22-8-2-5-17(18(22)21-12)24-9-3-4-13-6-7-14(19)10-15(13)20/h2,5-8,10,23H,3-4,9,11H2,1H3
InChIKeyKGJNESNNLBHUGZ-UHFFFAOYSA-N
MW365.26 g/mol
LogP4.45
Rot. Bonds6

About [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol

[8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol (PubChem CID 131737642) has the molecular formula C18H18Cl2N2O2 and a molecular weight of 365.26 g/mol. Its IUPAC name is [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol.

Molecular Properties

Compound Name[8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol
PubChem CID131737642
Molecular FormulaC18H18Cl2N2O2
Molecular Weight365.26 g/mol
Exact Mass364.07
IUPAC Name[8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol
SMILESCc1nc2c(OCCCc3ccc(Cl)cc3Cl)cccn2c1CO
InChIInChI=1S/C18H18Cl2N2O2/c1-12-16(11-23)22-8-2-5-17(18(22)21-12)24-9-3-4-13-6-7-14(19)10-15(13)20/h2,5-8,10,23H,3-4,9,11H2,1H3
InChIKeyKGJNESNNLBHUGZ-UHFFFAOYSA-N
XLogP4.45
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.26
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(8-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methanol
CID 82529517
2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 82055785
3-[1-(5-chloro-2-methylphenyl)-5-methylpyrazol-3-yl]-9-[(2,4-dichlorophenyl)methoxy]-2-methylpyrido[1,2-a]pyrimidin-4-one
CID 42804979
[8-(2,3-dihydro-1H-inden-1-yloxy)-2-methylimidazo[1,2-a]pyridin-3-yl]methanol
CID 70404568
[2-(2,5-dichlorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanol
CID 43478483
2,6-dichloro-N-[3-(hydroxymethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]benzamide
CID 54237289
2-[8-(2-amino-2-oxoethoxy)-2-methylimidazo[1,2-a]pyridin-3-yl]acetic acid
CID 82055736
2-[2-methyl-8-(2-methylprop-2-enoxy)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 82055750
2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide
CID 82055769
4-[2-[2-(2,4-dichlorophenyl)ethyl]phenoxy]-N,N-dimethylbutan-1-amine
CID 20545010
(6-chloro-2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methanol
CID 82531125
8-[(2-methoxyphenyl)methoxy]-2-methyl-3-prop-2-ynylimidazo[1,2-a]pyridine
CID 21286353

Frequently Asked Questions

What is the IUPAC name of [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol?
The IUPAC name of [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol (CID 131737642) is [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol.
What is the SMILES notation for [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol?
The canonical SMILES for [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol is Cc1nc2c(OCCCc3ccc(Cl)cc3Cl)cccn2c1CO.
What is the InChIKey of [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol?
The InChIKey is KGJNESNNLBHUGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O2/c1-12-16(11-23)22-8-2-5-17(18(22)21-12)24-9-3-4-13-6-7-14(19)10-15(13)20/h2,5-8,10,23H,3-4,9,11H2,1H3.
What are the key properties of [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol?
[8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol has a molecular weight of 365.26 g/mol, XLogP of 4.45, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol is sourced from PubChem (CID 131737642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).