[6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone

C20H25N5O2 — CID 135115714

IUPAC[6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1cncc(N2CCC(OCc3ccccn3)CC2)n1)N1CCCC1
InChIInChI=1S/C20H25N5O2/c26-20(25-9-3-4-10-25)18-13-21-14-19(23-18)24-11-6-17(7-12-24)27-15-16-5-1-2-8-22-16/h1-2,5,8,13-14,17H,3-4,6-7,9-12,15H2
InChIKeySAJPDFRIVSDDHV-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.29
Rot. Bonds5

About [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone

[6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone (PubChem CID 135115714) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone
PubChem CID135115714
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name[6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1cncc(N2CCC(OCc3ccccn3)CC2)n1)N1CCCC1
InChIInChI=1S/C20H25N5O2/c26-20(25-9-3-4-10-25)18-13-21-14-19(23-18)24-11-6-17(7-12-24)27-15-16-5-1-2-8-22-16/h1-2,5,8,13-14,17H,3-4,6-7,9-12,15H2
InChIKeySAJPDFRIVSDDHV-UHFFFAOYSA-N
XLogP2.29
TPSA71.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

piperidin-1-yl-(6-piperidin-1-ylpyrazin-2-yl)methanone
CID 165345728
(3R)-3-[4-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]piperidine-1-carboxamide
CID 97150223
cyclopropyl-[(2S)-2-[4-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]pyrrolidin-1-yl]methanone
CID 118776457
5-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]-6-pyrrolidin-1-yl-[1,2,5]oxadiazolo[3,4-b]pyrazine
CID 42101463
[6-[4-[hydroxy-(1-methylimidazol-2-yl)methyl]piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 134697141
[(3R,4R)-3-hydroxy-4-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrrolidin-1-yl]-(4-methoxyphenyl)methanone
CID 133132232
1-ethyl-5-[4-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]piperidin-2-one
CID 72865091
(6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]methanone
CID 97142061
1-cyclopropyl-4-[4-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]pyrrolidin-2-one
CID 70714333
1-[2-[3-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]phenyl]ethanone
CID 91766002
[3-(pyridin-2-ylmethoxy)piperidin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CID 91770782
[4-(3-methoxy-4-pyridinyl)phenyl]-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]methanone
CID 162633123

Frequently Asked Questions

What is the IUPAC name of [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone (CID 135115714) is [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone is O=C(c1cncc(N2CCC(OCc3ccccn3)CC2)n1)N1CCCC1.
What is the InChIKey of [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is SAJPDFRIVSDDHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c26-20(25-9-3-4-10-25)18-13-21-14-19(23-18)24-11-6-17(7-12-24)27-15-16-5-1-2-8-22-16/h1-2,5,8,13-14,17H,3-4,6-7,9-12,15H2.
What are the key properties of [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone?
[6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 367.45 g/mol, XLogP of 2.29, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 135115714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).