3-(2-methylfuran-3-yl)pyrazol-1-amine

C8H9N3O — CID 67417097

IUPAC3-(2-methylfuran-3-yl)pyrazol-1-amine
SMILESCc1occc1-c1ccn(N)n1
InChIInChI=1S/C8H9N3O/c1-6-7(3-5-12-6)8-2-4-11(9)10-8/h2-5H,9H2,1H3
InChIKeyLQLNQBGYHSNTGV-UHFFFAOYSA-N
MW163.18 g/mol
LogP1.17
Rot. Bonds1

About 3-(2-methylfuran-3-yl)pyrazol-1-amine

3-(2-methylfuran-3-yl)pyrazol-1-amine (PubChem CID 67417097) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 3-(2-methylfuran-3-yl)pyrazol-1-amine.

Molecular Properties

Compound Name3-(2-methylfuran-3-yl)pyrazol-1-amine
PubChem CID67417097
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name3-(2-methylfuran-3-yl)pyrazol-1-amine
SMILESCc1occc1-c1ccn(N)n1
InChIInChI=1S/C8H9N3O/c1-6-7(3-5-12-6)8-2-4-11(9)10-8/h2-5H,9H2,1H3
InChIKeyLQLNQBGYHSNTGV-UHFFFAOYSA-N
XLogP1.17
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-furyl)-4H-pyrazol-4-one N-(3-methylphenyl)hydrazone
CID 3301257
3-[[5-(furan-3-yl)-1H-pyrazol-3-yl]oxy]-N,N-dimethylpropan-1-amine
CID 10585842
3-(5-methylfuran-2-yl)-1H-pyrazole-4-carbaldehyde
CID 9267898
5-(2-methyl-5-phenylfuran-3-yl)-1H-pyrazole
CID 2742187
Tributyl-[6-(furan-3-yl)pyridazin-4-yl]stannane
CID 15362125
4-(3-Furyl)-1,2,3-triazole
CID 20255184
3-(3-Furyl)pyrazole
CID 53671153
(Furyl)(pyrazolyl)methane
CID 150420394
N-[4-(furan-2-yl)phenyl]-3-(trifluoromethyl)pyrazol-1-amine
CID 70106328
4-(furan-2-ylmethyl)-5-(trifluoromethyl)-1H-pyrazole
CID 90705521
[5-[5-methyl-2-(trifluoromethyl)furan-3-yl]-1H-pyrazol-4-yl]-phenyldiazene
CID 174472644
Tributyl-[3-(furan-3-yl)pyridazin-4-yl]stannane
CID 15362124

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylfuran-3-yl)pyrazol-1-amine?
The IUPAC name of 3-(2-methylfuran-3-yl)pyrazol-1-amine (CID 67417097) is 3-(2-methylfuran-3-yl)pyrazol-1-amine.
What is the SMILES notation for 3-(2-methylfuran-3-yl)pyrazol-1-amine?
The canonical SMILES for 3-(2-methylfuran-3-yl)pyrazol-1-amine is Cc1occc1-c1ccn(N)n1.
What is the InChIKey of 3-(2-methylfuran-3-yl)pyrazol-1-amine?
The InChIKey is LQLNQBGYHSNTGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-6-7(3-5-12-6)8-2-4-11(9)10-8/h2-5H,9H2,1H3.
What are the key properties of 3-(2-methylfuran-3-yl)pyrazol-1-amine?
3-(2-methylfuran-3-yl)pyrazol-1-amine has a molecular weight of 163.18 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylfuran-3-yl)pyrazol-1-amine is sourced from PubChem (CID 67417097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).