methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate

C10H10BrNO3 — CID 154595238

IUPACmethyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate
SMILESCOC(=O)c1cc(OC2CC2)ncc1Br
InChIInChI=1S/C10H10BrNO3/c1-14-10(13)7-4-9(12-5-8(7)11)15-6-2-3-6/h4-6H,2-3H2,1H3
InChIKeyMQTGPCICPWEKCV-UHFFFAOYSA-N
MW272.10 g/mol
LogP2.17
Rot. Bonds3

About methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate

methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate (PubChem CID 154595238) has the molecular formula C10H10BrNO3 and a molecular weight of 272.10 g/mol. Its IUPAC name is methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate
PubChem CID154595238
Molecular FormulaC10H10BrNO3
Molecular Weight272.10 g/mol
Exact Mass270.98
IUPAC Namemethyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate
SMILESCOC(=O)c1cc(OC2CC2)ncc1Br
InChIInChI=1S/C10H10BrNO3/c1-14-10(13)7-4-9(12-5-8(7)11)15-6-2-3-6/h4-6H,2-3H2,1H3
InChIKeyMQTGPCICPWEKCV-UHFFFAOYSA-N
XLogP2.17
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.10
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 5-bromo-2-propan-2-yloxypyridine-4-carboxylate
CID 86723769
methyl 5-bromo-2-(difluoromethoxy)pyridine-4-carboxylate
CID 138609183
5-bromo-2-cyclopropyloxy-4-methylpyridine
CID 118130740
methyl 5-bromo-2-iodopyridine-4-carboxylate
CID 91667368
methyl 5-bromo-2-chloropyridine-4-carboxylate
CID 26966728
nitroso 5-bromo-2-methoxypyridine-4-carboxylate
CID 175292393
5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide
CID 114090645
bis(5-bromo-2-methoxy-4-pyridinyl)methanone
CID 145284641
5-bromo-2-(4,4-dimethylcyclohexyl)oxy-4-methylpyridine
CID 114870816
2-amino-1-(5-bromo-2-methoxy-4-pyridinyl)ethanone
CID 84704798
methyl 5-bromo-2-fluoro-6-[4-[(6-methoxy-3-pyridinyl)oxy]piperidin-1-yl]pyridine-3-carboxylate
CID 135154375
methyl 5-bromo-2-(4,4-difluoropiperidin-1-yl)pyridine-4-carboxylate
CID 175640260

Frequently Asked Questions

What is the IUPAC name of methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate?
The IUPAC name of methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate (CID 154595238) is methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate.
What is the SMILES notation for methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate?
The canonical SMILES for methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate is COC(=O)c1cc(OC2CC2)ncc1Br.
What is the InChIKey of methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate?
The InChIKey is MQTGPCICPWEKCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrNO3/c1-14-10(13)7-4-9(12-5-8(7)11)15-6-2-3-6/h4-6H,2-3H2,1H3.
What are the key properties of methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate?
methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate has a molecular weight of 272.10 g/mol, XLogP of 2.17, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate is sourced from PubChem (CID 154595238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).