2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine

C13H21N3 — CID 59598917

IUPAC2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine
SMILESCC(C)C1(C)CCN(c2cnccn2)CC1
InChIInChI=1S/C13H21N3/c1-11(2)13(3)4-8-16(9-5-13)12-10-14-6-7-15-12/h6-7,10-11H,4-5,8-9H2,1-3H3
InChIKeyVDCKOFAZNZXGOA-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.74
Rot. Bonds2

About 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine

2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine (PubChem CID 59598917) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine
PubChem CID59598917
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine
SMILESCC(C)C1(C)CCN(c2cnccn2)CC1
InChIInChI=1S/C13H21N3/c1-11(2)13(3)4-8-16(9-5-13)12-10-14-6-7-15-12/h6-7,10-11H,4-5,8-9H2,1-3H3
InChIKeyVDCKOFAZNZXGOA-UHFFFAOYSA-N
XLogP2.74
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine?
The IUPAC name of 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine (CID 59598917) is 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine.
What is the SMILES notation for 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine?
The canonical SMILES for 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine is CC(C)C1(C)CCN(c2cnccn2)CC1.
What is the InChIKey of 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine?
The InChIKey is VDCKOFAZNZXGOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-11(2)13(3)4-8-16(9-5-13)12-10-14-6-7-15-12/h6-7,10-11H,4-5,8-9H2,1-3H3.
What are the key properties of 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine?
2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine has a molecular weight of 219.33 g/mol, XLogP of 2.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-4-propan-2-ylpiperidin-1-yl)pyrazine is sourced from PubChem (CID 59598917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).