4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine

C9H14N2 — CID 71437659

IUPAC4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine
SMILESCC1=C2C(=NCCN2C)CC1
InChIInChI=1S/C9H14N2/c1-7-3-4-8-9(7)11(2)6-5-10-8/h3-6H2,1-2H3
InChIKeyYWOGZPZQBMPZQU-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.44
Rot. Bonds

About 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine

4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine (PubChem CID 71437659) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine.

Molecular Properties

Compound Name4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine
PubChem CID71437659
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine
SMILESCC1=C2C(=NCCN2C)CC1
InChIInChI=1S/C9H14N2/c1-7-3-4-8-9(7)11(2)6-5-10-8/h3-6H2,1-2H3
InChIKeyYWOGZPZQBMPZQU-UHFFFAOYSA-N
XLogP1.44
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-methyl-2,3,5,6-tetrahydro-1H-cyclopenta[b]pyrazine
CID 12306163
1,5-Dimethyl-2,3,5,6-tetrahydro-1H-cyclopenta[b]pyrazine
CID 45099393
3,7-dimethyl-2,3,5,6-tetrahydro-1H-cyclopenta[b]pyrazine
CID 71437658
5,6-Dimethyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine
CID 22954785
1-Methyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine
CID 58207073
6-Methyl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine
CID 58223119
1-Tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine
CID 59140368
1-Ethyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine
CID 67124147
2-Methyl-6-propan-2-yl-3,4,5,7-tetrahydropyrrolo[2,3-c]pyridine
CID 131997933
2-Methyl-5-propan-2-yl-3,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
CID 131997936
6-Methyl-3,4,5,7-tetrahydropyrrolo[3,4-b]pyridine
CID 147626798
(7R)-4,7-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine
CID 98089194

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine?
The IUPAC name of 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine (CID 71437659) is 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine.
What is the SMILES notation for 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine?
The canonical SMILES for 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine is CC1=C2C(=NCCN2C)CC1.
What is the InChIKey of 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine?
The InChIKey is YWOGZPZQBMPZQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-7-3-4-8-9(7)11(2)6-5-10-8/h3-6H2,1-2H3.
What are the key properties of 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine?
4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine has a molecular weight of 150.22 g/mol, XLogP of 1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-2,3,6,7-tetrahydrocyclopenta[b]pyrazine is sourced from PubChem (CID 71437659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).