tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate

C15H24N4O2 — CID 56965637

IUPACtert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate
SMILESCC(C)(C)OC(=O)NCC1CCN(c2cnccn2)CC1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)21-14(20)18-10-12-4-8-19(9-5-12)13-11-16-6-7-17-13/h6-7,11-12H,4-5,8-10H2,1-3H3,(H,18,20)
InChIKeyFNUGBWCAWHMQGZ-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.22
Rot. Bonds3

About tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate

tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate (PubChem CID 56965637) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate
PubChem CID56965637
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Nametert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate
SMILESCC(C)(C)OC(=O)NCC1CCN(c2cnccn2)CC1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)21-14(20)18-10-12-4-8-19(9-5-12)13-11-16-6-7-17-13/h6-7,11-12H,4-5,8-10H2,1-3H3,(H,18,20)
InChIKeyFNUGBWCAWHMQGZ-UHFFFAOYSA-N
XLogP2.22
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl N-[[1-(pyrazine-2-carbonyl)piperidin-4-yl]methyl]carbamate
CID 71632480
tert-butyl N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]carbamate
CID 20801237
3-methyl-N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]butanamide
CID 121109026
3-cyclopentyl-N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]propanamide
CID 121109042
tert-butyl N-[[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]methyl]carbamate
CID 133300314
tert-butyl N-[[(3S)-1-(4-methyl-2-pyridinyl)pyrrolidin-3-yl]methyl]carbamate
CID 97176211
N-prop-2-enyl-N'-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxamide
CID 121107808
4-methyl-N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]thiophene-2-carboxamide
CID 71786550
N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide
CID 131911346
tert-butyl N-[[1-(2-chloro-4-pyridinyl)piperidin-4-yl]methyl]carbamate
CID 121204851
tert-butyl N-(1-pyrazin-2-ylazetidin-3-yl)carbamate
CID 66570422
tert-butyl N-[[(3S)-1-(pyrazine-2-carbonyl)piperidin-3-yl]methyl]carbamate
CID 94824268

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate?
The IUPAC name of tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate (CID 56965637) is tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate.
What is the SMILES notation for tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate?
The canonical SMILES for tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate is CC(C)(C)OC(=O)NCC1CCN(c2cnccn2)CC1.
What is the InChIKey of tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate?
The InChIKey is FNUGBWCAWHMQGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-15(2,3)21-14(20)18-10-12-4-8-19(9-5-12)13-11-16-6-7-17-13/h6-7,11-12H,4-5,8-10H2,1-3H3,(H,18,20).
What are the key properties of tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate?
tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate has a molecular weight of 292.38 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate is sourced from PubChem (CID 56965637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).