3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine

C10H13BrN2O — CID 105368575

IUPAC3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine
SMILESCc1cnc(OC2CCNC2)c(Br)c1
InChIInChI=1S/C10H13BrN2O/c1-7-4-9(11)10(13-5-7)14-8-2-3-12-6-8/h4-5,8,12H,2-3,6H2,1H3
InChIKeySNDNLGCMEYKWEN-UHFFFAOYSA-N
MW257.13 g/mol
LogP1.89
Rot. Bonds2

About 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine

3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine (PubChem CID 105368575) has the molecular formula C10H13BrN2O and a molecular weight of 257.13 g/mol. Its IUPAC name is 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine.

Molecular Properties

Compound Name3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine
PubChem CID105368575
Molecular FormulaC10H13BrN2O
Molecular Weight257.13 g/mol
Exact Mass256.02
IUPAC Name3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine
SMILESCc1cnc(OC2CCNC2)c(Br)c1
InChIInChI=1S/C10H13BrN2O/c1-7-4-9(11)10(13-5-7)14-8-2-3-12-6-8/h4-5,8,12H,2-3,6H2,1H3
InChIKeySNDNLGCMEYKWEN-UHFFFAOYSA-N
XLogP1.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.13
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-5-methyl-2-(4-methylcyclohexyl)oxypyridine
CID 105368228
5-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyrimidine
CID 95031425
3-bromo-2-[(3R)-pyrrolidin-3-yl]oxypyridine
CID 94406855
3,5-dichloro-2-pyrrolidin-3-yloxypyridine
CID 62347674
3,5-difluoro-2-pyrrolidin-3-yloxypyridine
CID 67479860
5-bromo-3-ethyl-2-pyrrolidin-3-yloxypyrazine
CID 167350866
2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine
CID 114838242
3-bromo-5-nitro-2-[(3S)-piperidin-3-yl]oxypyridine
CID 79523632
3-bromo-4-methyl-5-nitro-2-pyrrolidin-3-yloxypyridine
CID 104508420
2-methyl-3-pyrrolidin-3-yloxypyrazine;hydrochloride
CID 71639334
(3S)-3-(3,5-dimethylphenoxy)pyrrolidine
CID 26192104
5-bromo-2-pyrrolidin-3-yloxy-3-(trifluoromethyl)pyrazine
CID 167350738

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine?
The IUPAC name of 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine (CID 105368575) is 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine.
What is the SMILES notation for 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine?
The canonical SMILES for 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine is Cc1cnc(OC2CCNC2)c(Br)c1.
What is the InChIKey of 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine?
The InChIKey is SNDNLGCMEYKWEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O/c1-7-4-9(11)10(13-5-7)14-8-2-3-12-6-8/h4-5,8,12H,2-3,6H2,1H3.
What are the key properties of 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine?
3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine has a molecular weight of 257.13 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine is sourced from PubChem (CID 105368575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).