3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine

C9H12N2 — CID 53400736

IUPAC3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine
SMILESCC1CN=C2C=CC=C2N1C
InChIInChI=1S/C9H12N2/c1-7-6-10-8-4-3-5-9(8)11(7)2/h3-5,7H,6H2,1-2H3
InChIKeyXTCMAVYCITVFLA-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.22
Rot. Bonds

About 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine

3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine (PubChem CID 53400736) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine.

Molecular Properties

Compound Name3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine
PubChem CID53400736
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine
SMILESCC1CN=C2C=CC=C2N1C
InChIInChI=1S/C9H12N2/c1-7-6-10-8-4-3-5-9(8)11(7)2/h3-5,7H,6H2,1-2H3
InChIKeyXTCMAVYCITVFLA-UHFFFAOYSA-N
XLogP1.22
TPSA15.60 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 ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Methyl-2,3-dihydrocyclopenta[b]pyrazine
CID 66649807
2-Ethyl-1-methyl-3a,7a-dihydropyrrolo[3,2-b]pyridine
CID 117611845
1,2-Dimethyl-3a,7a-dihydropyrrolo[3,2-b]pyridine
CID 118491724
1-Ethyl-4-methylidene-5-(3-methylpent-2-enylidene)-6-prop-1-enyl-2,3-dihydropyrazine-1,4-diium
CID 123195700
1,2-Dimethyl-3a,7a-dihydropyrrolo[3,2-b]pyridine;ethane
CID 144955040
N,N,2-trimethyl-1-[(2E)-3-methylimino-2-prop-2-enylidenepyrrol-1-yl]propan-2-amine
CID 162389292
1,5-Dimethyl-3a,7a-dihydropyrrolo[3,2-b]pyridine
CID 165379437
(2Z)-1,3-dimethyl-2-prop-2-enylidenepyrazine
CID 168245428
1-Methyl-2,3-dihydrocyclohepta[b]pyrazine
CID 21782758
2-methyl-1-methylidene-8aH-pyrrolo[1,2-a]pyrazin-5-ium
CID 157739835
2,3-dimethyl-4aH-pyrrolo[2,3-b]indolizin-9-ium
CID 162202806
propan-2-yl-[(1Z)-2,2,2-trideuterio-1-[1-methyl-6-[N-propan-2-yl-C-(trideuteriomethyl)carbonimidoyl]-2-pyridinylidene]ethyl]azanide
CID 177442783

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine?
The IUPAC name of 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine (CID 53400736) is 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine.
What is the SMILES notation for 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine?
The canonical SMILES for 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine is CC1CN=C2C=CC=C2N1C.
What is the InChIKey of 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine?
The InChIKey is XTCMAVYCITVFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-7-6-10-8-4-3-5-9(8)11(7)2/h3-5,7H,6H2,1-2H3.
What are the key properties of 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine?
3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine has a molecular weight of 148.21 g/mol, XLogP of 1.22, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-2,3-dihydrocyclopenta[b]pyrazine is sourced from PubChem (CID 53400736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).