N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine

C10H14FN3 — CID 164648190

IUPACN-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine
SMILESCC[C@@H]1C[C@H]1CNc1nccnc1F
InChIInChI=1S/C10H14FN3/c1-2-7-5-8(7)6-14-10-9(11)12-3-4-13-10/h3-4,7-8H,2,5-6H2,1H3,(H,13,14)/t7-,8+/m1/s1
InChIKeyWYXCDECQXZSXFO-SFYZADRCSA-N
MW195.24 g/mol
LogP2.07
Rot. Bonds4

About N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine

N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine (PubChem CID 164648190) has the molecular formula C10H14FN3 and a molecular weight of 195.24 g/mol. Its IUPAC name is N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine.

Molecular Properties

Compound NameN-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine
PubChem CID164648190
Molecular FormulaC10H14FN3
Molecular Weight195.24 g/mol
Exact Mass195.12
IUPAC NameN-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine
SMILESCC[C@@H]1C[C@H]1CNc1nccnc1F
InChIInChI=1S/C10H14FN3/c1-2-7-5-8(7)6-14-10-9(11)12-3-4-13-10/h3-4,7-8H,2,5-6H2,1H3,(H,13,14)/t7-,8+/m1/s1
InChIKeyWYXCDECQXZSXFO-SFYZADRCSA-N
XLogP2.07
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)pyrazin-2-amine
CID 43215345
N-Butyl-2-pyrazinamine
CID 14715225
N-[[(4R)-3,3-difluoropiperidin-4-yl]methyl]pyrazin-2-amine
CID 124107544
N-[(3,3-difluoropiperidin-4-yl)methyl]pyrazin-2-amine
CID 140878873
2-(3-Fluoro-5-methylpiperidin-1-yl)pyrazine
CID 163561941
6-fluoro-N-propylpyrazin-2-amine
CID 163935498
2-Fluoro-3-(4-methylpiperidin-1-yl)pyrazine
CID 164648143
2-(3-Fluoro-5-propan-2-ylpiperidin-1-yl)pyrazine
CID 167364064
2-(4-Ethylpiperidin-1-yl)-3-fluoropyrazine
CID 174276449
2-Fluoro-3-(4-propan-2-ylpiperidin-1-yl)pyrazine
CID 176552975
N-(2-methylpropyl)pyrazin-2-amine
CID 21583046
N-octylpyrazin-2-amine
CID 12143372

Frequently Asked Questions

What is the IUPAC name of N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine?
The IUPAC name of N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine (CID 164648190) is N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine.
What is the SMILES notation for N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine?
The canonical SMILES for N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine is CC[C@@H]1C[C@H]1CNc1nccnc1F.
What is the InChIKey of N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine?
The InChIKey is WYXCDECQXZSXFO-SFYZADRCSA-N. The full InChI is InChI=1S/C10H14FN3/c1-2-7-5-8(7)6-14-10-9(11)12-3-4-13-10/h3-4,7-8H,2,5-6H2,1H3,(H,13,14)/t7-,8+/m1/s1.
What are the key properties of N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine?
N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine has a molecular weight of 195.24 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-3-fluoropyrazin-2-amine is sourced from PubChem (CID 164648190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).