5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid

C10H12N2O3 — CID 114408700

IUPAC5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid
SMILESNc1ccc(C(=O)O)nc1OCC1CC1
InChIInChI=1S/C10H12N2O3/c11-7-3-4-8(10(13)14)12-9(7)15-5-6-1-2-6/h3-4,6H,1-2,5,11H2,(H,13,14)
InChIKeyMSXLMKAKFLAZRB-UHFFFAOYSA-N
MW208.22 g/mol
LogP1.15
Rot. Bonds4

About 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid

5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid (PubChem CID 114408700) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid
PubChem CID114408700
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid
SMILESNc1ccc(C(=O)O)nc1OCC1CC1
InChIInChI=1S/C10H12N2O3/c11-7-3-4-8(10(13)14)12-9(7)15-5-6-1-2-6/h3-4,6H,1-2,5,11H2,(H,13,14)
InChIKeyMSXLMKAKFLAZRB-UHFFFAOYSA-N
XLogP1.15
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid?
The IUPAC name of 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid (CID 114408700) is 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid.
What is the SMILES notation for 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid?
The canonical SMILES for 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid is Nc1ccc(C(=O)O)nc1OCC1CC1.
What is the InChIKey of 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid?
The InChIKey is MSXLMKAKFLAZRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c11-7-3-4-8(10(13)14)12-9(7)15-5-6-1-2-6/h3-4,6H,1-2,5,11H2,(H,13,14).
What are the key properties of 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid?
5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid has a molecular weight of 208.22 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid is sourced from PubChem (CID 114408700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).