4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid

C14H10ClN3O3 — CID 59803122

IUPAC4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid
SMILESCn1cnc2c(Oc3cccc(Cl)c3)ncc(C(=O)O)c21
InChIInChI=1S/C14H10ClN3O3/c1-18-7-17-11-12(18)10(14(19)20)6-16-13(11)21-9-4-2-3-8(15)5-9/h2-7H,1H3,(H,19,20)
InChIKeyHUKYTZKJJDNIOB-UHFFFAOYSA-N
MW303.71 g/mol
LogP3.11
Rot. Bonds3

About 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid

4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid (PubChem CID 59803122) has the molecular formula C14H10ClN3O3 and a molecular weight of 303.71 g/mol. Its IUPAC name is 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid
PubChem CID59803122
Molecular FormulaC14H10ClN3O3
Molecular Weight303.71 g/mol
Exact Mass303.04
IUPAC Name4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid
SMILESCn1cnc2c(Oc3cccc(Cl)c3)ncc(C(=O)O)c21
InChIInChI=1S/C14H10ClN3O3/c1-18-7-17-11-12(18)10(14(19)20)6-16-13(11)21-9-4-2-3-8(15)5-9/h2-7H,1H3,(H,19,20)
InChIKeyHUKYTZKJJDNIOB-UHFFFAOYSA-N
XLogP3.11
TPSA77.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.71
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-chlorophenoxy)-5-fluoropyridine-3-carboxylic acid
CID 67367395
[4-(3-chlorophenoxy)-1-methylpyrrolo[3,2-c]pyridin-7-yl]-pyrrolidin-1-ylmethanone
CID 71058545
[4-(3-chlorophenoxy)-2-phenylpyrimidin-5-yl]-pyrrolidin-1-ylmethanone
CID 42670092
2-(3-chlorophenoxy)-4-methylbenzoic acid
CID 55107381
3-[(3-chlorophenoxy)methyl]-1-methylindole-7-carboxylic acid
CID 117182146
3,5-dichloro-2-(3-chlorophenoxy)pyridine
CID 91013057
1-[(5-chloro-3-pyridinyl)oxy]isoquinoline-4-carboxylic acid
CID 106765808
1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid
CID 83883068
3-(3-chlorophenyl)-1-methylpyrazole-4-carboxylic acid
CID 43141384
2-amino-5-[(3,5-dichloro-2-pyridinyl)oxy]benzoic acid
CID 43566444
5-(3-chlorophenoxy)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 166397540
N-[5-(3-chlorophenoxy)-2-pyridinyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 139521731

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid?
The IUPAC name of 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid (CID 59803122) is 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid.
What is the SMILES notation for 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid?
The canonical SMILES for 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid is Cn1cnc2c(Oc3cccc(Cl)c3)ncc(C(=O)O)c21.
What is the InChIKey of 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid?
The InChIKey is HUKYTZKJJDNIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O3/c1-18-7-17-11-12(18)10(14(19)20)6-16-13(11)21-9-4-2-3-8(15)5-9/h2-7H,1H3,(H,19,20).
What are the key properties of 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid?
4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid has a molecular weight of 303.71 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenoxy)-1-methylimidazo[4,5-c]pyridine-7-carboxylic acid is sourced from PubChem (CID 59803122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).