3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine

C9H12N2 — CID 530404

IUPAC3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine
SMILESCc1cnc2c(n1)CCC2C
InChIInChI=1S/C9H12N2/c1-6-3-4-8-9(6)10-5-7(2)11-8/h5-6H,3-4H2,1-2H3
InChIKeyCTFGVWCFSGCLHZ-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.83
Rot. Bonds

About 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine

3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine (PubChem CID 530404) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine.

Molecular Properties

Compound Name3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine
PubChem CID530404
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine
SMILESCc1cnc2c(n1)CCC2C
InChIInChI=1S/C9H12N2/c1-6-3-4-8-9(6)10-5-7(2)11-8/h5-6H,3-4H2,1-2H3
InChIKeyCTFGVWCFSGCLHZ-UHFFFAOYSA-N
XLogP1.83
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine?
The IUPAC name of 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine (CID 530404) is 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine.
What is the SMILES notation for 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine?
The canonical SMILES for 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine is Cc1cnc2c(n1)CCC2C.
What is the InChIKey of 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine?
The InChIKey is CTFGVWCFSGCLHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-6-3-4-8-9(6)10-5-7(2)11-8/h5-6H,3-4H2,1-2H3.
What are the key properties of 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine?
3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine has a molecular weight of 148.21 g/mol, XLogP of 1.83, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyrazine is sourced from PubChem (CID 530404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).