[1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate

C16H24N4O4 — CID 126813332

IUPAC[1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate
SMILESCNC(=O)OCC1CCCCN1C(=O)c1cnc(OC(C)C)cn1
InChIInChI=1S/C16H24N4O4/c1-11(2)24-14-9-18-13(8-19-14)15(21)20-7-5-4-6-12(20)10-23-16(22)17-3/h8-9,11-12H,4-7,10H2,1-3H3,(H,17,22)
InChIKeyOSLMUQXTMAEKSC-UHFFFAOYSA-N
MW336.39 g/mol
LogP1.61
Rot. Bonds5

About [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate

[1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate (PubChem CID 126813332) has the molecular formula C16H24N4O4 and a molecular weight of 336.39 g/mol. Its IUPAC name is [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate.

Molecular Properties

Compound Name[1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate
PubChem CID126813332
Molecular FormulaC16H24N4O4
Molecular Weight336.39 g/mol
Exact Mass336.18
IUPAC Name[1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate
SMILESCNC(=O)OCC1CCCCN1C(=O)c1cnc(OC(C)C)cn1
InChIInChI=1S/C16H24N4O4/c1-11(2)24-14-9-18-13(8-19-14)15(21)20-7-5-4-6-12(20)10-23-16(22)17-3/h8-9,11-12H,4-7,10H2,1-3H3,(H,17,22)
InChIKeyOSLMUQXTMAEKSC-UHFFFAOYSA-N
XLogP1.61
TPSA93.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(5-aminopyrazin-2-yl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
CID 107375180
methyl 2-[1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]acetate
CID 61009273
(2-ethylpiperidin-1-yl)-(5-hydrazinylpyrazin-2-yl)methanone
CID 107378063
[2-(2-hydroxypropyl)azepan-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 79552839
[2-(hydroxymethyl)pyrrolidin-1-yl]-[5-(methylamino)pyrazin-2-yl]methanone
CID 107375092
(5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
CID 107257609
N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide
CID 166354866
[2-[2-(1-methylimidazol-2-yl)ethyl]piperidin-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 70756795
(2-ethylpiperidin-1-yl)-[5-(2-methoxyethylamino)pyrazin-2-yl]methanone
CID 109275908
[2-(aminomethyl)piperidin-1-yl]-(5-bromo-2-pyridinyl)methanone
CID 62957995
2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid
CID 129468796
6-[(2R)-2-(propan-2-yloxymethyl)pyrrolidine-1-carbonyl]pyridine-2-carboxylic acid
CID 58714878

Frequently Asked Questions

What is the IUPAC name of [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate?
The IUPAC name of [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate (CID 126813332) is [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate.
What is the SMILES notation for [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate?
The canonical SMILES for [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate is CNC(=O)OCC1CCCCN1C(=O)c1cnc(OC(C)C)cn1.
What is the InChIKey of [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate?
The InChIKey is OSLMUQXTMAEKSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O4/c1-11(2)24-14-9-18-13(8-19-14)15(21)20-7-5-4-6-12(20)10-23-16(22)17-3/h8-9,11-12H,4-7,10H2,1-3H3,(H,17,22).
What are the key properties of [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate?
[1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate has a molecular weight of 336.39 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate is sourced from PubChem (CID 126813332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).