4-amino-6-chloroquinoline-2-carboxylic acid

C10H7ClN2O2 — CID 46398171

IUPAC4-amino-6-chloroquinoline-2-carboxylic acid
SMILESNc1cc(C(=O)O)nc2ccc(Cl)cc12
InChIInChI=1S/C10H7ClN2O2/c11-5-1-2-8-6(3-5)7(12)4-9(13-8)10(14)15/h1-4H,(H2,12,13)(H,14,15)
InChIKeyJQHCGFKAHQTMID-UHFFFAOYSA-N
MW222.63 g/mol
LogP2.17
Rot. Bonds1

About 4-amino-6-chloroquinoline-2-carboxylic acid

4-amino-6-chloroquinoline-2-carboxylic acid (PubChem CID 46398171) has the molecular formula C10H7ClN2O2 and a molecular weight of 222.63 g/mol. Its IUPAC name is 4-amino-6-chloroquinoline-2-carboxylic acid.

Molecular Properties

Compound Name4-amino-6-chloroquinoline-2-carboxylic acid
PubChem CID46398171
Molecular FormulaC10H7ClN2O2
Molecular Weight222.63 g/mol
Exact Mass222.02
IUPAC Name4-amino-6-chloroquinoline-2-carboxylic acid
SMILESNc1cc(C(=O)O)nc2ccc(Cl)cc12
InChIInChI=1S/C10H7ClN2O2/c11-5-1-2-8-6(3-5)7(12)4-9(13-8)10(14)15/h1-4H,(H2,12,13)(H,14,15)
InChIKeyJQHCGFKAHQTMID-UHFFFAOYSA-N
XLogP2.17
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.63
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-aminoquinoline-2-carboxylic acid;hydrochloride
CID 171379335
4,7-dichloroquinoline-2-carboxylic acid
CID 21426380
4-amino-6,7-dimethoxyquinoline-2-carboxylic acid
CID 84632987
4-amino-6-chloroquinoline-2-carbonitrile
CID 84620141
2-(2-aminoethyl)-6-chloroquinoline-4-carboxylic acid
CID 84634019
6-chloro-4-methylquinazoline-2-carboxylic acid
CID 84788769
6-amino-2-(4-chlorophenyl)pyrimidine-4-carboxylic acid
CID 46863985
6-amino-5-(5-chloro-2-methylphenyl)pyridine-2-carboxylic acid
CID 82556214
methyl 4,6-dichloroquinazoline-2-carboxylate
CID 131622673
2-(5-amino-2-pyridinyl)-6-chloroquinoline-4-carboxylic acid;ethane
CID 145387367
6-chloro-1-hydroxybenzimidazole-2-carboxylic acid
CID 123194154
2,6-dichloro-4-oxoquinazoline-3-carboxylic acid
CID 117264136

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-chloroquinoline-2-carboxylic acid?
The IUPAC name of 4-amino-6-chloroquinoline-2-carboxylic acid (CID 46398171) is 4-amino-6-chloroquinoline-2-carboxylic acid.
What is the SMILES notation for 4-amino-6-chloroquinoline-2-carboxylic acid?
The canonical SMILES for 4-amino-6-chloroquinoline-2-carboxylic acid is Nc1cc(C(=O)O)nc2ccc(Cl)cc12.
What is the InChIKey of 4-amino-6-chloroquinoline-2-carboxylic acid?
The InChIKey is JQHCGFKAHQTMID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN2O2/c11-5-1-2-8-6(3-5)7(12)4-9(13-8)10(14)15/h1-4H,(H2,12,13)(H,14,15).
What are the key properties of 4-amino-6-chloroquinoline-2-carboxylic acid?
4-amino-6-chloroquinoline-2-carboxylic acid has a molecular weight of 222.63 g/mol, XLogP of 2.17, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-chloroquinoline-2-carboxylic acid is sourced from PubChem (CID 46398171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).