3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide

C10H17N5O — CID 165476105

IUPAC3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide
SMILESCCc1nnc2n1CC(C(=O)N(C)C)NC2
InChIInChI=1S/C10H17N5O/c1-4-8-12-13-9-5-11-7(6-15(8)9)10(16)14(2)3/h7,11H,4-6H2,1-3H3
InChIKeyHGPBHIQARWODCK-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.60
Rot. Bonds2

About 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide

3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide (PubChem CID 165476105) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide.

Molecular Properties

Compound Name3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide
PubChem CID165476105
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide
SMILESCCc1nnc2n1CC(C(=O)N(C)C)NC2
InChIInChI=1S/C10H17N5O/c1-4-8-12-13-9-5-11-7(6-15(8)9)10(16)14(2)3/h7,11H,4-6H2,1-3H3
InChIKeyHGPBHIQARWODCK-UHFFFAOYSA-N
XLogP-0.60
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide?
The IUPAC name of 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide (CID 165476105) is 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide.
What is the SMILES notation for 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide?
The canonical SMILES for 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide is CCc1nnc2n1CC(C(=O)N(C)C)NC2.
What is the InChIKey of 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide?
The InChIKey is HGPBHIQARWODCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-4-8-12-13-9-5-11-7(6-15(8)9)10(16)14(2)3/h7,11H,4-6H2,1-3H3.
What are the key properties of 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide?
3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide has a molecular weight of 223.28 g/mol, XLogP of -0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N,N-dimethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine-6-carboxamide is sourced from PubChem (CID 165476105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).