pyrazin-2-ylmethyl N-tert-butylcarbamate

C10H15N3O2 — CID 174542549

IUPACpyrazin-2-ylmethyl N-tert-butylcarbamate
SMILESCC(C)(C)NC(=O)OCc1cnccn1
InChIInChI=1S/C10H15N3O2/c1-10(2,3)13-9(14)15-7-8-6-11-4-5-12-8/h4-6H,7H2,1-3H3,(H,13,14)
InChIKeyHXLHSWLCMRCZSI-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.50
Rot. Bonds2

About pyrazin-2-ylmethyl N-tert-butylcarbamate

pyrazin-2-ylmethyl N-tert-butylcarbamate (PubChem CID 174542549) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is pyrazin-2-ylmethyl N-tert-butylcarbamate.

Molecular Properties

Compound Namepyrazin-2-ylmethyl N-tert-butylcarbamate
PubChem CID174542549
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Namepyrazin-2-ylmethyl N-tert-butylcarbamate
SMILESCC(C)(C)NC(=O)OCc1cnccn1
InChIInChI=1S/C10H15N3O2/c1-10(2,3)13-9(14)15-7-8-6-11-4-5-12-8/h4-6H,7H2,1-3H3,(H,13,14)
InChIKeyHXLHSWLCMRCZSI-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

Analyze pyrazin-2-ylmethyl N-tert-butylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

pyridin-4-ylmethyl N-tert-butylcarbamate
CID 59402004
tert-butyl N-(pyrazin-2-ylmethyl)carbamate
CID 66970536
2-amino-2-methyl-3-pyrazin-2-ylpropanoic acid
CID 130039613
[2-[bis[(4-methoxyphenyl)methyl]amino]pyrimidin-4-yl]methyl N-tert-butylcarbamate
CID 175327963
ethyl N-[4-(pyrazin-2-ylmethylamino)phenyl]carbamate
CID 62762350
2-methyl-1-pyrazin-2-ylpropan-2-amine
CID 82594901
2-(tert-butylcarbamoyloxy)ethyl N-tert-butylcarbamate
CID 176596941
1,4-di(pyrazin-2-yl)butane-2,3-dione
CID 57316761
methyl 3-methyl-2-(pyrazin-2-ylmethylamino)butanoate
CID 62761624
2-pyrazin-2-ylacetic acid
CID 19797048
(5,10-dioxopyrido[3,2-g]quinolin-3-yl)methyl N-tert-butylcarbamate
CID 11809932
(4-acetamidophenyl)methyl N-tert-butylcarbamate
CID 155455042

Frequently Asked Questions

What is the IUPAC name of pyrazin-2-ylmethyl N-tert-butylcarbamate?
The IUPAC name of pyrazin-2-ylmethyl N-tert-butylcarbamate (CID 174542549) is pyrazin-2-ylmethyl N-tert-butylcarbamate.
What is the SMILES notation for pyrazin-2-ylmethyl N-tert-butylcarbamate?
The canonical SMILES for pyrazin-2-ylmethyl N-tert-butylcarbamate is CC(C)(C)NC(=O)OCc1cnccn1.
What is the InChIKey of pyrazin-2-ylmethyl N-tert-butylcarbamate?
The InChIKey is HXLHSWLCMRCZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-10(2,3)13-9(14)15-7-8-6-11-4-5-12-8/h4-6H,7H2,1-3H3,(H,13,14).
What are the key properties of pyrazin-2-ylmethyl N-tert-butylcarbamate?
pyrazin-2-ylmethyl N-tert-butylcarbamate 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 pyrazin-2-ylmethyl N-tert-butylcarbamate is sourced from PubChem (CID 174542549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).