3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine

C9H12FN3 — CID 164648101

IUPAC3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine
SMILESCC1CCC1Nc1nccnc1F
InChIInChI=1S/C9H12FN3/c1-6-2-3-7(6)13-9-8(10)11-4-5-12-9/h4-7H,2-3H2,1H3,(H,12,13)
InChIKeyXFVPQAIEQGHONI-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.83
Rot. Bonds2

About 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine

3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine (PubChem CID 164648101) has the molecular formula C9H12FN3 and a molecular weight of 181.21 g/mol. Its IUPAC name is 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine
PubChem CID164648101
Molecular FormulaC9H12FN3
Molecular Weight181.21 g/mol
Exact Mass181.10
IUPAC Name3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine
SMILESCC1CCC1Nc1nccnc1F
InChIInChI=1S/C9H12FN3/c1-6-2-3-7(6)13-9-8(10)11-4-5-12-9/h4-7H,2-3H2,1H3,(H,12,13)
InChIKeyXFVPQAIEQGHONI-UHFFFAOYSA-N
XLogP1.83
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(2-methylcyclobutyl)pyrazin-2-amine
CID 126981523
5-chloro-3-fluoro-N-(2-methylcyclobutyl)pyridin-2-amine
CID 130556137
3-[(2-methylcyclohexyl)amino]pyrazine-2-carbonitrile
CID 62672162
3-fluoro-N-(2-methyloxolan-3-yl)pyridin-2-amine
CID 82729049
2-N-(2-methylcyclopentyl)pyridine-2,3-diamine
CID 63278381
N-(2-methylcyclopentyl)-3-propan-2-yloxypyrazin-2-amine
CID 133470298
5-fluoro-N-(2-methylcyclobutyl)pyridin-3-amine
CID 130554519
3-N-[(1R,2R)-2-methylcyclopropyl]pyrazine-2,3-diamine
CID 131014799
6-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine
CID 164646795
3-fluoro-5-methyl-N-(2-methylcyclobutyl)aniline
CID 130171740
2-fluoro-6-methyl-N-(2-methylcyclobutyl)pyrimidin-4-amine
CID 164645816
N-(2-methylcyclopropyl)-3-(trifluoromethyl)pyridin-2-amine
CID 62397155

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine?
The IUPAC name of 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine (CID 164648101) is 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine.
What is the SMILES notation for 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine?
The canonical SMILES for 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine is CC1CCC1Nc1nccnc1F.
What is the InChIKey of 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine?
The InChIKey is XFVPQAIEQGHONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FN3/c1-6-2-3-7(6)13-9-8(10)11-4-5-12-9/h4-7H,2-3H2,1H3,(H,12,13).
What are the key properties of 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine?
3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine has a molecular weight of 181.21 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(2-methylcyclobutyl)pyrazin-2-amine is sourced from PubChem (CID 164648101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).