3,5-dichloro-2-pyrrolidin-3-yloxypyridine

C9H10Cl2N2O — CID 62347674

IUPAC3,5-dichloro-2-pyrrolidin-3-yloxypyridine
SMILESClc1cnc(OC2CCNC2)c(Cl)c1
InChIInChI=1S/C9H10Cl2N2O/c10-6-3-8(11)9(13-4-6)14-7-1-2-12-5-7/h3-4,7,12H,1-2,5H2
InChIKeyZYEFRTVHPNXEFQ-UHFFFAOYSA-N
MW233.10 g/mol
LogP2.13
Rot. Bonds2

About 3,5-dichloro-2-pyrrolidin-3-yloxypyridine

3,5-dichloro-2-pyrrolidin-3-yloxypyridine (PubChem CID 62347674) has the molecular formula C9H10Cl2N2O and a molecular weight of 233.10 g/mol. Its IUPAC name is 3,5-dichloro-2-pyrrolidin-3-yloxypyridine.

Molecular Properties

Compound Name3,5-dichloro-2-pyrrolidin-3-yloxypyridine
PubChem CID62347674
Molecular FormulaC9H10Cl2N2O
Molecular Weight233.10 g/mol
Exact Mass232.02
IUPAC Name3,5-dichloro-2-pyrrolidin-3-yloxypyridine
SMILESClc1cnc(OC2CCNC2)c(Cl)c1
InChIInChI=1S/C9H10Cl2N2O/c10-6-3-8(11)9(13-4-6)14-7-1-2-12-5-7/h3-4,7,12H,1-2,5H2
InChIKeyZYEFRTVHPNXEFQ-UHFFFAOYSA-N
XLogP2.13
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.10
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-4-[(3R)-pyrrolidin-3-yl]oxypyrimidine
CID 118464443
3,5-difluoro-2-pyrrolidin-3-yloxypyridine
CID 67479860
3-chloro-5-nitro-2-piperidin-3-yloxypyridine
CID 114046940
3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine
CID 105368575
2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine
CID 114838242
3-chloro-4-pyrrolidin-3-yloxypyridine
CID 79840362
2-methyl-3-pyrrolidin-3-yloxypyrazine;hydrochloride
CID 71639334
3,5-dichloro-2-[(S)-phenyl-[(3R)-pyrrolidin-3-yl]methoxy]pyridine
CID 66752614
3,5-dichloro-2-[phenyl-[(3S)-pyrrolidin-3-yl]methoxy]pyridine
CID 66753028
3-bromo-2-[(3R)-pyrrolidin-3-yl]oxypyridine
CID 94406855
3-fluoro-2-[(3S)-pyrrolidin-3-yl]oxypyridine
CID 94573941
3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride
CID 86276895

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-2-pyrrolidin-3-yloxypyridine?
The IUPAC name of 3,5-dichloro-2-pyrrolidin-3-yloxypyridine (CID 62347674) is 3,5-dichloro-2-pyrrolidin-3-yloxypyridine.
What is the SMILES notation for 3,5-dichloro-2-pyrrolidin-3-yloxypyridine?
The canonical SMILES for 3,5-dichloro-2-pyrrolidin-3-yloxypyridine is Clc1cnc(OC2CCNC2)c(Cl)c1.
What is the InChIKey of 3,5-dichloro-2-pyrrolidin-3-yloxypyridine?
The InChIKey is ZYEFRTVHPNXEFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2N2O/c10-6-3-8(11)9(13-4-6)14-7-1-2-12-5-7/h3-4,7,12H,1-2,5H2.
What are the key properties of 3,5-dichloro-2-pyrrolidin-3-yloxypyridine?
3,5-dichloro-2-pyrrolidin-3-yloxypyridine has a molecular weight of 233.10 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2-pyrrolidin-3-yloxypyridine is sourced from PubChem (CID 62347674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).