2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid

C10H12N2O2 — CID 83698075

IUPAC2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid
SMILESCc1cc(C(=O)O)cc(NC2CC2)n1
InChIInChI=1S/C10H12N2O2/c1-6-4-7(10(13)14)5-9(11-6)12-8-2-3-8/h4-5,8H,2-3H2,1H3,(H,11,12)(H,13,14)
InChIKeyHIXCGWMBQNSEKG-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.66
Rot. Bonds3

About 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid

2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid (PubChem CID 83698075) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid
PubChem CID83698075
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid
SMILESCc1cc(C(=O)O)cc(NC2CC2)n1
InChIInChI=1S/C10H12N2O2/c1-6-4-7(10(13)14)5-9(11-6)12-8-2-3-8/h4-5,8H,2-3H2,1H3,(H,11,12)(H,13,14)
InChIKeyHIXCGWMBQNSEKG-UHFFFAOYSA-N
XLogP1.66
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid?
The IUPAC name of 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid (CID 83698075) is 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid.
What is the SMILES notation for 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid?
The canonical SMILES for 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid is Cc1cc(C(=O)O)cc(NC2CC2)n1.
What is the InChIKey of 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid?
The InChIKey is HIXCGWMBQNSEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-6-4-7(10(13)14)5-9(11-6)12-8-2-3-8/h4-5,8H,2-3H2,1H3,(H,11,12)(H,13,14).
What are the key properties of 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid?
2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid has a molecular weight of 192.22 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-6-methylpyridine-4-carboxylic acid is sourced from PubChem (CID 83698075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).