2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate

C10H15N3O2 — CID 173380932

IUPAC2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate
SMILESCC(C)COC(=O)N(C)c1cnccn1
InChIInChI=1S/C10H15N3O2/c1-8(2)7-15-10(14)13(3)9-6-11-4-5-12-9/h4-6,8H,7H2,1-3H3
InChIKeyWPCAQRHUISSLOF-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.71
Rot. Bonds3

About 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate

2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate (PubChem CID 173380932) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate.

Molecular Properties

Compound Name2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate
PubChem CID173380932
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate
SMILESCC(C)COC(=O)N(C)c1cnccn1
InChIInChI=1S/C10H15N3O2/c1-8(2)7-15-10(14)13(3)9-6-11-4-5-12-9/h4-6,8H,7H2,1-3H3
InChIKeyWPCAQRHUISSLOF-UHFFFAOYSA-N
XLogP1.71
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate?
The IUPAC name of 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate (CID 173380932) is 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate.
What is the SMILES notation for 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate?
The canonical SMILES for 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate is CC(C)COC(=O)N(C)c1cnccn1.
What is the InChIKey of 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate?
The InChIKey is WPCAQRHUISSLOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8(2)7-15-10(14)13(3)9-6-11-4-5-12-9/h4-6,8H,7H2,1-3H3.
What are the key properties of 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate?
2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate has a molecular weight of 209.25 g/mol, XLogP of 1.71, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropyl N-methyl-N-pyrazin-2-ylcarbamate is sourced from PubChem (CID 173380932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).