4-bromo-3-(cyclopropylmethoxy)pyridine

C9H10BrNO — CID 90156558

IUPAC4-bromo-3-(cyclopropylmethoxy)pyridine
SMILESBrc1ccncc1OCC1CC1
InChIInChI=1S/C9H10BrNO/c10-8-3-4-11-5-9(8)12-6-7-1-2-7/h3-5,7H,1-2,6H2
InChIKeyHJUQXYXNUGDDRN-UHFFFAOYSA-N
MW228.09 g/mol
LogP2.63
Rot. Bonds3

About 4-bromo-3-(cyclopropylmethoxy)pyridine

4-bromo-3-(cyclopropylmethoxy)pyridine (PubChem CID 90156558) has the molecular formula C9H10BrNO and a molecular weight of 228.09 g/mol. Its IUPAC name is 4-bromo-3-(cyclopropylmethoxy)pyridine.

Molecular Properties

Compound Name4-bromo-3-(cyclopropylmethoxy)pyridine
PubChem CID90156558
Molecular FormulaC9H10BrNO
Molecular Weight228.09 g/mol
Exact Mass226.99
IUPAC Name4-bromo-3-(cyclopropylmethoxy)pyridine
SMILESBrc1ccncc1OCC1CC1
InChIInChI=1S/C9H10BrNO/c10-8-3-4-11-5-9(8)12-6-7-1-2-7/h3-5,7H,1-2,6H2
InChIKeyHJUQXYXNUGDDRN-UHFFFAOYSA-N
XLogP2.63
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.09
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-3-(oxolan-3-ylmethoxy)pyridine
CID 90421245
3-bromo-4-(piperidin-4-ylmethoxy)pyridine
CID 104779217
3-(cyclopropylmethoxy)-4-methoxypyridine
CID 150318193
3-(cyclopentylmethoxy)-4-fluoropyridine
CID 142361626
6-(cyclopropylmethoxy)isoquinolin-5-amine
CID 106948623
5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine
CID 144638458
N-[[3-(cyclopropylmethoxy)-4-pyridinyl]methyl]cyclopropanamine
CID 105075090
[3-(cyclopentylmethoxy)-4-pyridinyl]methanol
CID 105067194
4-fluoro-3-(piperidin-4-ylmethoxy)pyridine
CID 142361424
3-methyl-4-(piperidin-4-ylmethoxy)pyridine;dihydrochloride
CID 154582386
4-(cyclopentylmethoxy)pyridine-3-carboxylic acid
CID 81225610
4-(piperidin-4-ylmethoxy)-3-(trifluoromethyl)pyridine
CID 166105232

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-(cyclopropylmethoxy)pyridine?
The IUPAC name of 4-bromo-3-(cyclopropylmethoxy)pyridine (CID 90156558) is 4-bromo-3-(cyclopropylmethoxy)pyridine.
What is the SMILES notation for 4-bromo-3-(cyclopropylmethoxy)pyridine?
The canonical SMILES for 4-bromo-3-(cyclopropylmethoxy)pyridine is Brc1ccncc1OCC1CC1.
What is the InChIKey of 4-bromo-3-(cyclopropylmethoxy)pyridine?
The InChIKey is HJUQXYXNUGDDRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrNO/c10-8-3-4-11-5-9(8)12-6-7-1-2-7/h3-5,7H,1-2,6H2.
What are the key properties of 4-bromo-3-(cyclopropylmethoxy)pyridine?
4-bromo-3-(cyclopropylmethoxy)pyridine has a molecular weight of 228.09 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-(cyclopropylmethoxy)pyridine is sourced from PubChem (CID 90156558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).