6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine

C19H20N4O — CID 133308222

IUPAC6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine
SMILESc1ccc(OCC2CCCN(c3ccc4nccnc4n3)C2)cc1
InChIInChI=1S/C19H20N4O/c1-2-6-16(7-3-1)24-14-15-5-4-12-23(13-15)18-9-8-17-19(22-18)21-11-10-20-17/h1-3,6-11,15H,4-5,12-14H2
InChIKeyZLFBPOHCBNEGJJ-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.32
Rot. Bonds4

About 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine

6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine (PubChem CID 133308222) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine
PubChem CID133308222
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine
SMILESc1ccc(OCC2CCCN(c3ccc4nccnc4n3)C2)cc1
InChIInChI=1S/C19H20N4O/c1-2-6-16(7-3-1)24-14-15-5-4-12-23(13-15)18-9-8-17-19(22-18)21-11-10-20-17/h1-3,6-11,15H,4-5,12-14H2
InChIKeyZLFBPOHCBNEGJJ-UHFFFAOYSA-N
XLogP3.32
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-6-[3-(phenoxymethyl)piperidin-1-yl]pyrimidine
CID 133308306
6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine
CID 126874369
2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]quinoxaline
CID 163353005
2-[3-[(3-methoxyphenoxy)methyl]piperidin-1-yl]pyrazine
CID 70780919
3-cyclopropyl-6-[3-(phenoxymethyl)piperidin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 133308216
2-(difluoromethyl)-4-[3-(phenoxymethyl)piperidin-1-yl]quinazoline
CID 133308282
4-ethyl-6-[3-(phenoxymethyl)piperidin-1-yl]-2-pyridin-4-ylpyrimidine
CID 133308307
6-[4-(2-methoxyethyl)-3-methylpiperazin-1-yl]pyrido[2,3-b]pyrazine
CID 133301736
2-phenyl-4-pyrido[2,3-b]pyrazin-6-ylmorpholine
CID 75368986
4-[3-(ethoxymethyl)piperidin-1-yl]-2-methylpyrimidine
CID 123680686
(3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide
CID 97348278
N-(cyclopropylmethyl)-1-pyrido[2,3-b]pyrazin-6-ylpiperidin-4-amine
CID 115307509

Frequently Asked Questions

What is the IUPAC name of 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine?
The IUPAC name of 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine (CID 133308222) is 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine.
What is the SMILES notation for 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine?
The canonical SMILES for 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine is c1ccc(OCC2CCCN(c3ccc4nccnc4n3)C2)cc1.
What is the InChIKey of 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine?
The InChIKey is ZLFBPOHCBNEGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-2-6-16(7-3-1)24-14-15-5-4-12-23(13-15)18-9-8-17-19(22-18)21-11-10-20-17/h1-3,6-11,15H,4-5,12-14H2.
What are the key properties of 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine?
6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine has a molecular weight of 320.40 g/mol, XLogP of 3.32, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine is sourced from PubChem (CID 133308222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).