N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine

C10H14FN3 — CID 164646887

IUPACN-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine
SMILESCCC1CC1CNc1cncc(F)n1
InChIInChI=1S/C10H14FN3/c1-2-7-3-8(7)4-13-10-6-12-5-9(11)14-10/h5-8H,2-4H2,1H3,(H,13,14)
InChIKeyJGOQIXMBHJYELQ-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.07
Rot. Bonds4

About N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine

N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine (PubChem CID 164646887) has the molecular formula C10H14FN3 and a molecular weight of 195.24 g/mol. Its IUPAC name is N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine.

Molecular Properties

Compound NameN-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine
PubChem CID164646887
Molecular FormulaC10H14FN3
Molecular Weight195.24 g/mol
Exact Mass195.12
IUPAC NameN-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine
SMILESCCC1CC1CNc1cncc(F)n1
InChIInChI=1S/C10H14FN3/c1-2-7-3-8(7)4-13-10-6-12-5-9(11)14-10/h5-8H,2-4H2,1H3,(H,13,14)
InChIKeyJGOQIXMBHJYELQ-UHFFFAOYSA-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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Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine?
The IUPAC name of N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine (CID 164646887) is N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine.
What is the SMILES notation for N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine?
The canonical SMILES for N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine is CCC1CC1CNc1cncc(F)n1.
What is the InChIKey of N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine?
The InChIKey is JGOQIXMBHJYELQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3/c1-2-7-3-8(7)4-13-10-6-12-5-9(11)14-10/h5-8H,2-4H2,1H3,(H,13,14).
What are the key properties of N-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine?
N-[(2-ethylcyclopropyl)methyl]-6-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-[(2-ethylcyclopropyl)methyl]-6-fluoropyrazin-2-amine is sourced from PubChem (CID 164646887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).