2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine

C14H16Cl3N5O — CID 158311700

IUPAC2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine
SMILESCOCC1CCCN1c1cncc(Cl)n1.Clc1cncc(Cl)n1
InChIInChI=1S/C10H14ClN3O.C4H2Cl2N2/c1-15-7-8-3-2-4-14(8)10-6-12-5-9(11)13-10;5-3-1-7-2-4(6)8-3/h5-6,8H,2-4,7H2,1H3;1-2H
InChIKeyGNTHIIQVNYUDBW-UHFFFAOYSA-N
MW376.68 g/mol
LogP3.53
Rot. Bonds3

About 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine

2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine (PubChem CID 158311700) has the molecular formula C14H16Cl3N5O and a molecular weight of 376.68 g/mol. Its IUPAC name is 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine.

Molecular Properties

Compound Name2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine
PubChem CID158311700
Molecular FormulaC14H16Cl3N5O
Molecular Weight376.68 g/mol
Exact Mass375.04
IUPAC Name2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine
SMILESCOCC1CCCN1c1cncc(Cl)n1.Clc1cncc(Cl)n1
InChIInChI=1S/C10H14ClN3O.C4H2Cl2N2/c1-15-7-8-3-2-4-14(8)10-6-12-5-9(11)13-10;5-3-1-7-2-4(6)8-3/h5-6,8H,2-4,7H2,1H3;1-2H
InChIKeyGNTHIIQVNYUDBW-UHFFFAOYSA-N
XLogP3.53
TPSA64.03 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.68
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine?
The IUPAC name of 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine (CID 158311700) is 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine.
What is the SMILES notation for 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine?
The canonical SMILES for 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine is COCC1CCCN1c1cncc(Cl)n1.Clc1cncc(Cl)n1.
What is the InChIKey of 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine?
The InChIKey is GNTHIIQVNYUDBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O.C4H2Cl2N2/c1-15-7-8-3-2-4-14(8)10-6-12-5-9(11)13-10;5-3-1-7-2-4(6)8-3/h5-6,8H,2-4,7H2,1H3;1-2H.
What are the key properties of 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine?
2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine has a molecular weight of 376.68 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[2-(methoxymethyl)pyrrolidin-1-yl]pyrazine;2,6-dichloropyrazine is sourced from PubChem (CID 158311700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).