4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine

C10H12FN3O — CID 165492593

IUPAC4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine
SMILESCn1nc(CCc2ccco2)c(F)c1N
InChIInChI=1S/C10H12FN3O/c1-14-10(12)9(11)8(13-14)5-4-7-3-2-6-15-7/h2-3,6H,4-5,12H2,1H3
InChIKeyIOCFLSGZRPOWOO-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.52
Rot. Bonds3

About 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine

4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine (PubChem CID 165492593) has the molecular formula C10H12FN3O and a molecular weight of 209.22 g/mol. Its IUPAC name is 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine
PubChem CID165492593
Molecular FormulaC10H12FN3O
Molecular Weight209.22 g/mol
Exact Mass209.10
IUPAC Name4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine
SMILESCn1nc(CCc2ccco2)c(F)c1N
InChIInChI=1S/C10H12FN3O/c1-14-10(12)9(11)8(13-14)5-4-7-3-2-6-15-7/h2-3,6H,4-5,12H2,1H3
InChIKeyIOCFLSGZRPOWOO-UHFFFAOYSA-N
XLogP1.52
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(furan-2-yl)ethyl]-1-methyl-4-(3-methylphenyl)pyrazol-5-amine
CID 62829943
3-ethyl-5-N-(furan-2-ylmethyl)-5-N,1-dimethylpyrazole-4,5-diamine
CID 66014982
2-(1,1-dioxothiolan-3-yl)-5-[2-(furan-2-yl)ethyl]-4-methylpyrazol-3-amine
CID 43336832
3-(cyclohexylmethyl)-4-fluoro-1-methylpyrazol-5-amine
CID 165492596
[3-(furan-2-yl)-1-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 105307383
1-(3-ethyl-1-methylpyrazol-5-yl)-4-(furan-2-yl)butan-2-amine
CID 105160147
5-N-[2-(furan-2-yl)ethyl]-3-methyl-1-propylpyrazole-4,5-diamine
CID 66029181
3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
CID 43158243
N-[[3-[2-(furan-2-yl)ethyl]imidazol-4-yl]methyl]-2-methylpropan-2-amine
CID 66148632
2-bromo-5-[2-(furan-2-yl)ethyl]-1,3,4-thiadiazole
CID 63383961
2-(2-methoxyethyl)furan
CID 19010334
2-(2-methylsulfanylethyl)furan
CID 45489970

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine?
The IUPAC name of 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine (CID 165492593) is 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine?
The canonical SMILES for 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine is Cn1nc(CCc2ccco2)c(F)c1N.
What is the InChIKey of 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine?
The InChIKey is IOCFLSGZRPOWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3O/c1-14-10(12)9(11)8(13-14)5-4-7-3-2-6-15-7/h2-3,6H,4-5,12H2,1H3.
What are the key properties of 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine?
4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine has a molecular weight of 209.22 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-[2-(furan-2-yl)ethyl]-1-methylpyrazol-5-amine is sourced from PubChem (CID 165492593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).