tert-butyl N-(pyrazin-2-ylmethyl)carbamate

C10H15N3O2 — CID 66970536

IUPACtert-butyl N-(pyrazin-2-ylmethyl)carbamate
SMILESCC(C)(C)OC(=O)NCc1cnccn1
InChIInChI=1S/C10H15N3O2/c1-10(2,3)15-9(14)13-7-8-6-11-4-5-12-8/h4-6H,7H2,1-3H3,(H,13,14)
InChIKeyWCKWYIUYVUUQRC-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.50
Rot. Bonds2

About tert-butyl N-(pyrazin-2-ylmethyl)carbamate

tert-butyl N-(pyrazin-2-ylmethyl)carbamate (PubChem CID 66970536) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is tert-butyl N-(pyrazin-2-ylmethyl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(pyrazin-2-ylmethyl)carbamate
PubChem CID66970536
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Nametert-butyl N-(pyrazin-2-ylmethyl)carbamate
SMILESCC(C)(C)OC(=O)NCc1cnccn1
InChIInChI=1S/C10H15N3O2/c1-10(2,3)15-9(14)13-7-8-6-11-4-5-12-8/h4-6H,7H2,1-3H3,(H,13,14)
InChIKeyWCKWYIUYVUUQRC-UHFFFAOYSA-N
XLogP1.50
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[(6-chloropyrazin-2-yl)methyl]carbamate
CID 77231610
tert-butyl N-[2-fluoro-5-(pyrazin-2-ylmethylamino)phenyl]carbamate
CID 107240673
tert-butyl N-(3-pyrazin-2-ylprop-2-ynyl)carbamate
CID 130869027
tert-butyl N-[3-oxo-3-(pyrazin-2-ylamino)propyl]carbamate
CID 122135229
tert-butyl N-(pyrazolo[1,5-a]pyrazin-2-ylmethyl)carbamate
CID 177333870
tert-butyl N-[[4-(phenoxymethyl)-2-pyridinyl]methyl]carbamate
CID 156818686
tert-butyl N-pyrazin-2-ylcarbamate;ethane
CID 153338007
tert-butyl N-[[5-(triazol-2-yl)-2-pyridinyl]methyl]carbamate
CID 166103677
N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide
CID 62763041
4-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-4-pyridinyl]benzoic acid
CID 18617692
tert-butyl N-[(1-ethylpyrazol-3-yl)methyl]carbamate
CID 163355422
tert-butyl N-[(2-tert-butyl-1,3-thiazol-5-yl)methyl]carbamate
CID 133059461

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(pyrazin-2-ylmethyl)carbamate?
The IUPAC name of tert-butyl N-(pyrazin-2-ylmethyl)carbamate (CID 66970536) is tert-butyl N-(pyrazin-2-ylmethyl)carbamate.
What is the SMILES notation for tert-butyl N-(pyrazin-2-ylmethyl)carbamate?
The canonical SMILES for tert-butyl N-(pyrazin-2-ylmethyl)carbamate is CC(C)(C)OC(=O)NCc1cnccn1.
What is the InChIKey of tert-butyl N-(pyrazin-2-ylmethyl)carbamate?
The InChIKey is WCKWYIUYVUUQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-10(2,3)15-9(14)13-7-8-6-11-4-5-12-8/h4-6H,7H2,1-3H3,(H,13,14).
What are the key properties of tert-butyl N-(pyrazin-2-ylmethyl)carbamate?
tert-butyl N-(pyrazin-2-ylmethyl)carbamate has a molecular weight of 209.25 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(pyrazin-2-ylmethyl)carbamate is sourced from PubChem (CID 66970536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).