2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine

C11H15N3O — CID 62716130

IUPAC2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine
SMILESCCn1cc(CC(N)c2ccco2)cn1
InChIInChI=1S/C11H15N3O/c1-2-14-8-9(7-13-14)6-10(12)11-4-3-5-15-11/h3-5,7-8,10H,2,6,12H2,1H3
InChIKeySNMFWQCTCJOVGH-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.74
Rot. Bonds4

About 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine

2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine (PubChem CID 62716130) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine
PubChem CID62716130
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine
SMILESCCn1cc(CC(N)c2ccco2)cn1
InChIInChI=1S/C11H15N3O/c1-2-14-8-9(7-13-14)6-10(12)11-4-3-5-15-11/h3-5,7-8,10H,2,6,12H2,1H3
InChIKeySNMFWQCTCJOVGH-UHFFFAOYSA-N
XLogP1.74
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanol
CID 62717465
(1R)-N-[(1-ethylpyrazol-4-yl)methyl]-1-(furan-2-yl)ethanamine
CID 81400661
2-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylethanamine
CID 62126098
2-(1-ethylpyrazol-4-yl)-1-(4-fluorophenyl)ethanamine
CID 62126251
2-(1-ethylpyrazol-4-yl)-1-(3-iodophenyl)ethanamine
CID 115822187
[2-(1-ethylpyrazol-4-yl)-1-(3-methylfuran-2-yl)ethyl]hydrazine
CID 105269319
1-(2,6-dimethyl-4-pyridinyl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 107503308
2-(1-ethylpyrazol-4-yl)-1-pyrimidin-4-ylethanamine
CID 63989978
2-amino-3-(1-ethylpyrazol-4-yl)propan-1-ol
CID 64571799
1-(1-benzothiophen-2-yl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 115822474
2-[(1-ethylpyrazol-4-yl)methyl]butan-1-amine
CID 62505904
2-(1-ethylpyrazol-4-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 105115043

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine (CID 62716130) is 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine is CCn1cc(CC(N)c2ccco2)cn1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine?
The InChIKey is SNMFWQCTCJOVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-2-14-8-9(7-13-14)6-10(12)11-4-3-5-15-11/h3-5,7-8,10H,2,6,12H2,1H3.
What are the key properties of 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine?
2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine has a molecular weight of 205.26 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)-1-(furan-2-yl)ethanamine is sourced from PubChem (CID 62716130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).