5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid

C10H10BrNO3 — CID 21109708

IUPAC5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid
SMILESO=C(O)c1cnc(OCC2CC2)c(Br)c1
InChIInChI=1S/C10H10BrNO3/c11-8-3-7(10(13)14)4-12-9(8)15-5-6-1-2-6/h3-4,6H,1-2,5H2,(H,13,14)
InChIKeyNDDUCEMRFZUCTI-UHFFFAOYSA-N
MW272.10 g/mol
LogP2.33
Rot. Bonds4

About 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid

5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid (PubChem CID 21109708) has the molecular formula C10H10BrNO3 and a molecular weight of 272.10 g/mol. Its IUPAC name is 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid
PubChem CID21109708
Molecular FormulaC10H10BrNO3
Molecular Weight272.10 g/mol
Exact Mass270.98
IUPAC Name5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid
SMILESO=C(O)c1cnc(OCC2CC2)c(Br)c1
InChIInChI=1S/C10H10BrNO3/c11-8-3-7(10(13)14)4-12-9(8)15-5-6-1-2-6/h3-4,6H,1-2,5H2,(H,13,14)
InChIKeyNDDUCEMRFZUCTI-UHFFFAOYSA-N
XLogP2.33
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.10
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-6-ethoxypyridine-3-carboxylic acid
CID 66835474
3-bromo-5-chloro-2-(cyclopropylmethoxy)pyridine
CID 114837615
[(3aR,6aR)-5-[5-bromo-6-(cyclopropylmethoxy)pyridine-3-carbonyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-(2H-benzotriazol-5-yl)methanone
CID 118270744
3-bromo-5-chloro-2-(cyclopentylmethoxy)pyridine
CID 114837797
5-bromo-4-(cyclopropylmethoxy)pyrimidine
CID 66320949
5-chloro-6-(cyclopropylmethoxy)-N-methylpyridine-3-carboxamide
CID 75503604
3,4-bis(cyclopropylmethoxy)benzoic acid
CID 102594223
3-bromo-5-chloro-2-(oxan-4-ylmethoxy)pyridine
CID 114837736
3-bromo-4-(cyclopropylmethoxymethyl)benzoic acid
CID 102765407
5-bromo-6-(oxan-4-ylmethoxy)pyridin-3-amine
CID 79534671
5-(cyclopropylmethoxymethoxy)pyridine-3-carboxylic acid
CID 106929024
6-(cyclopentylmethoxy)pyridine-3-carboxylic acid
CID 66324302

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid?
The IUPAC name of 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid (CID 21109708) is 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid.
What is the SMILES notation for 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid?
The canonical SMILES for 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid is O=C(O)c1cnc(OCC2CC2)c(Br)c1.
What is the InChIKey of 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid?
The InChIKey is NDDUCEMRFZUCTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrNO3/c11-8-3-7(10(13)14)4-12-9(8)15-5-6-1-2-6/h3-4,6H,1-2,5H2,(H,13,14).
What are the key properties of 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid?
5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid has a molecular weight of 272.10 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid is sourced from PubChem (CID 21109708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).