2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine

C20H20ClN5O2 — CID 154806612

IUPAC2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine
SMILESClc1cncc(OC2CCN(Cc3ccc(Oc4cnccn4)cc3)CC2)n1
InChIInChI=1S/C20H20ClN5O2/c21-18-11-23-13-20(25-18)28-17-5-9-26(10-6-17)14-15-1-3-16(4-2-15)27-19-12-22-7-8-24-19/h1-4,7-8,11-13,17H,5-6,9-10,14H2
InChIKeyPGGNGUGBDPWNNC-UHFFFAOYSA-N
MW397.87 g/mol
LogP3.76
Rot. Bonds6

About 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine

2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine (PubChem CID 154806612) has the molecular formula C20H20ClN5O2 and a molecular weight of 397.87 g/mol. Its IUPAC name is 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine.

Molecular Properties

Compound Name2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine
PubChem CID154806612
Molecular FormulaC20H20ClN5O2
Molecular Weight397.87 g/mol
Exact Mass397.13
IUPAC Name2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine
SMILESClc1cncc(OC2CCN(Cc3ccc(Oc4cnccn4)cc3)CC2)n1
InChIInChI=1S/C20H20ClN5O2/c21-18-11-23-13-20(25-18)28-17-5-9-26(10-6-17)14-15-1-3-16(4-2-15)27-19-12-22-7-8-24-19/h1-4,7-8,11-13,17H,5-6,9-10,14H2
InChIKeyPGGNGUGBDPWNNC-UHFFFAOYSA-N
XLogP3.76
TPSA73.26 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.87
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine with MolForge

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Related Compounds

2-[4-[[(3R)-3-pyridin-4-yloxypyrrolidin-1-yl]methyl]phenoxy]pyrazine
CID 97160514
2-[4-[(4-pyrazin-2-yloxypiperidin-1-yl)methyl]phenoxy]-[1,3]thiazolo[4,5-b]pyridine
CID 58382734
[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]-bis[4-(trifluoromethyl)phenyl]methanol
CID 171984961
2-[4-(6-chloropyrazin-2-yl)oxypiperidin-1-yl]-4-methyl-6-phenoxypyrimidine
CID 154850968
2-[1-[(3-methoxy-4-pyrrolidin-1-ylphenyl)methyl]piperidin-4-yl]oxypyrazine
CID 46980830
2-(4-pyrazin-2-yloxyphenoxy)pyrazine
CID 101444877
2-[1-[(3-methoxy-4-pyrrolidin-1-ylphenyl)methyl]piperidin-4-yl]oxypyrazine;hydrobromide
CID 171667785
[3-methyl-1-[(4-pyrazin-2-yloxyphenyl)methyl]pyrrolidin-3-yl]methanamine
CID 120780919
2-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]pyrazine
CID 154580959
2-[4-[(2,5-dimethylpiperazin-1-yl)methyl]phenoxy]pyrazine
CID 120906234
2-[(4-pyrazin-2-yloxyphenyl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120908350
2-[1-[(1-phenylpyrazol-3-yl)methyl]piperidin-4-yl]oxypyrazine
CID 136537514

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine?
The IUPAC name of 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine (CID 154806612) is 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine.
What is the SMILES notation for 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine?
The canonical SMILES for 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine is Clc1cncc(OC2CCN(Cc3ccc(Oc4cnccn4)cc3)CC2)n1.
What is the InChIKey of 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine?
The InChIKey is PGGNGUGBDPWNNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClN5O2/c21-18-11-23-13-20(25-18)28-17-5-9-26(10-6-17)14-15-1-3-16(4-2-15)27-19-12-22-7-8-24-19/h1-4,7-8,11-13,17H,5-6,9-10,14H2.
What are the key properties of 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine?
2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine has a molecular weight of 397.87 g/mol, XLogP of 3.76, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[1-[(4-pyrazin-2-yloxyphenyl)methyl]piperidin-4-yl]oxypyrazine is sourced from PubChem (CID 154806612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).