2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine

C8H14FN3 — CID 84654115

IUPAC2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine
SMILESNCCc1ccnn1CCCF
InChIInChI=1S/C8H14FN3/c9-4-1-7-12-8(2-5-10)3-6-11-12/h3,6H,1-2,4-5,7,10H2
InChIKeyCGYCOPPRXJLUDE-UHFFFAOYSA-N
MW171.22 g/mol
LogP0.74
Rot. Bonds5

About 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine

2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine (PubChem CID 84654115) has the molecular formula C8H14FN3 and a molecular weight of 171.22 g/mol. Its IUPAC name is 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine
PubChem CID84654115
Molecular FormulaC8H14FN3
Molecular Weight171.22 g/mol
Exact Mass171.12
IUPAC Name2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine
SMILESNCCc1ccnn1CCCF
InChIInChI=1S/C8H14FN3/c9-4-1-7-12-8(2-5-10)3-6-11-12/h3,6H,1-2,4-5,7,10H2
InChIKeyCGYCOPPRXJLUDE-UHFFFAOYSA-N
XLogP0.74
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-fluoro-3-methylbutyl)pyrazol-3-yl]ethanamine
CID 84668987
2-[2-(cyclopropylmethyl)pyrazol-3-yl]ethanamine
CID 84652253
3-[5-(hydroxymethyl)pyrazol-1-yl]propan-1-ol
CID 156694771
1-butyl-5-ethylpyrazole
CID 23006159
[2-(3-fluoro-3-methylbutyl)pyrazol-3-yl]methanamine
CID 84660191
5-(3-bromopropyl)-1-propylpyrazole
CID 64506458
[2-[3-(2-methoxyethoxy)propyl]pyrazol-3-yl]methanamine
CID 103413473
N-[[2-(2-fluoroethyl)pyrazol-3-yl]methyl]-1-(2-propylpyrazol-3-yl)methanamine
CID 122166952
N'-methyl-N'-[(2-propylpyrazol-3-yl)methyl]ethane-1,2-diamine
CID 114556320
N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine
CID 103015761
6-(2-aminoethyl)-1-methylpyrimidin-2-one
CID 83851762
2-[1-(3-fluoropropyl)pyrrol-3-yl]ethanamine
CID 84653816

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine?
The IUPAC name of 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine (CID 84654115) is 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine.
What is the SMILES notation for 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine?
The canonical SMILES for 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine is NCCc1ccnn1CCCF.
What is the InChIKey of 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine?
The InChIKey is CGYCOPPRXJLUDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN3/c9-4-1-7-12-8(2-5-10)3-6-11-12/h3,6H,1-2,4-5,7,10H2.
What are the key properties of 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine?
2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine has a molecular weight of 171.22 g/mol, XLogP of 0.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-fluoropropyl)pyrazol-3-yl]ethanamine is sourced from PubChem (CID 84654115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).