N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine

C14H14FN3 — CID 122139755

IUPACN-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine
SMILESFc1cccc(C2CC(Nc3cnccn3)C2)c1
InChIInChI=1S/C14H14FN3/c15-12-3-1-2-10(6-12)11-7-13(8-11)18-14-9-16-4-5-17-14/h1-6,9,11,13H,7-8H2,(H,17,18)
InChIKeyZZOSYMLKKWPABS-UHFFFAOYSA-N
MW243.29 g/mol
LogP2.97
Rot. Bonds3

About N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine

N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine (PubChem CID 122139755) has the molecular formula C14H14FN3 and a molecular weight of 243.29 g/mol. Its IUPAC name is N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine
PubChem CID122139755
Molecular FormulaC14H14FN3
Molecular Weight243.29 g/mol
Exact Mass243.12
IUPAC NameN-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine
SMILESFc1cccc(C2CC(Nc3cnccn3)C2)c1
InChIInChI=1S/C14H14FN3/c15-12-3-1-2-10(6-12)11-7-13(8-11)18-14-9-16-4-5-17-14/h1-6,9,11,13H,7-8H2,(H,17,18)
InChIKeyZZOSYMLKKWPABS-UHFFFAOYSA-N
XLogP2.97
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-fluoro-N-[3-(3-fluorophenyl)cyclobutyl]pyridin-2-amine
CID 115619378
N-[3-(3-fluorophenyl)cyclobutyl]-3-methoxyaniline
CID 43633962
6-[[3-(3-fluorophenyl)cyclobutyl]amino]pyridine-2-carboxylic acid
CID 122057127
N-[3-(3-fluorophenyl)cyclobutyl]hydroxylamine
CID 82686213
2,5-dibromo-N-[3-(3-fluorophenyl)cyclobutyl]aniline
CID 43736844
2,4,5-trichloro-N-[3-(3-fluorophenyl)cyclobutyl]aniline
CID 43633053
2-chloro-5-fluoro-N-[3-(3-fluorophenyl)cyclobutyl]aniline
CID 107527502
3-fluoro-N-[3-(3-methoxyphenyl)cyclobutyl]aniline
CID 43633456
3-chloro-2-fluoro-N-[3-(3-fluorophenyl)cyclobutyl]aniline
CID 43634997
3-fluoro-N-[3-(3-fluorophenyl)cyclobutyl]-4-methylaniline
CID 43633782
2,6-dichloro-4-[[3-(3-fluorophenyl)cyclobutyl]amino]phenol
CID 107679299
2,4-dibromo-N-[3-(3-fluorophenyl)cyclobutyl]aniline
CID 43683227

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine?
The IUPAC name of N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine (CID 122139755) is N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine.
What is the SMILES notation for N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine?
The canonical SMILES for N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine is Fc1cccc(C2CC(Nc3cnccn3)C2)c1.
What is the InChIKey of N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine?
The InChIKey is ZZOSYMLKKWPABS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3/c15-12-3-1-2-10(6-12)11-7-13(8-11)18-14-9-16-4-5-17-14/h1-6,9,11,13H,7-8H2,(H,17,18).
What are the key properties of N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine?
N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine has a molecular weight of 243.29 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-fluorophenyl)cyclobutyl]pyrazin-2-amine is sourced from PubChem (CID 122139755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).