2-chloro-3-pyrrolidin-1-ylpyrazine

C8H10ClN3 — CID 51072290

IUPAC2-chloro-3-pyrrolidin-1-ylpyrazine
SMILESClc1nccnc1N1CCCC1
InChIInChI=1S/C8H10ClN3/c9-7-8(11-4-3-10-7)12-5-1-2-6-12/h3-4H,1-2,5-6H2
InChIKeyYNPNSGOWGHKGGA-UHFFFAOYSA-N
MW183.64 g/mol
LogP1.73
Rot. Bonds1

About 2-chloro-3-pyrrolidin-1-ylpyrazine

2-chloro-3-pyrrolidin-1-ylpyrazine (PubChem CID 51072290) has the molecular formula C8H10ClN3 and a molecular weight of 183.64 g/mol. Its IUPAC name is 2-chloro-3-pyrrolidin-1-ylpyrazine.

Molecular Properties

Compound Name2-chloro-3-pyrrolidin-1-ylpyrazine
PubChem CID51072290
Molecular FormulaC8H10ClN3
Molecular Weight183.64 g/mol
Exact Mass183.06
IUPAC Name2-chloro-3-pyrrolidin-1-ylpyrazine
SMILESClc1nccnc1N1CCCC1
InChIInChI=1S/C8H10ClN3/c9-7-8(11-4-3-10-7)12-5-1-2-6-12/h3-4H,1-2,5-6H2
InChIKeyYNPNSGOWGHKGGA-UHFFFAOYSA-N
XLogP1.73
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Chloro-6-(pyrrolidin-1-yl)pyrazine
CID 26967054
6-chloro-N,N-dimethylpyrazin-2-amine
CID 23273443
3-Chloro-N,N-dimethylpyrazin-2-amine
CID 20483427
6-(Pyrrolidin-1-yl)pyrazin-2-amine
CID 66520349
1-(6-Chloropyrazin-2-yl)azepane
CID 53408186
N-butyl-6-chloro-N-methylpyrazin-2-amine
CID 53410844
2-Chloro-6-(2-ethyl-1H-imidazol-1-yl)-pyrazine
CID 61405312
Methanimidamide, N'-(3-chloro-2-pyrazinyl)-N,N-dimethyl-
CID 12229476
2-(Pyrrolidin-1-yl)pyrazine
CID 60052430
2-N,2-N,3-N-trimethyl-3-N-[(3S)-3-pyrrolidin-1-ylbutyl]pyrazine-2,3-diamine
CID 164631385
2-Chloro-6-(3,3-difluoropyrrolidin-1-yl)pyrazine
CID 86681768
2-Chloro-3-(4,4-difluoropiperidin-1-yl)pyrazine
CID 121200767

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-pyrrolidin-1-ylpyrazine?
The IUPAC name of 2-chloro-3-pyrrolidin-1-ylpyrazine (CID 51072290) is 2-chloro-3-pyrrolidin-1-ylpyrazine.
What is the SMILES notation for 2-chloro-3-pyrrolidin-1-ylpyrazine?
The canonical SMILES for 2-chloro-3-pyrrolidin-1-ylpyrazine is Clc1nccnc1N1CCCC1.
What is the InChIKey of 2-chloro-3-pyrrolidin-1-ylpyrazine?
The InChIKey is YNPNSGOWGHKGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3/c9-7-8(11-4-3-10-7)12-5-1-2-6-12/h3-4H,1-2,5-6H2.
What are the key properties of 2-chloro-3-pyrrolidin-1-ylpyrazine?
2-chloro-3-pyrrolidin-1-ylpyrazine has a molecular weight of 183.64 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-pyrrolidin-1-ylpyrazine is sourced from PubChem (CID 51072290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).