1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine

C11H15N3O — CID 19626815

IUPAC1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine
SMILESCCn1cc(NCc2ccco2)c(C)n1
InChIInChI=1S/C11H15N3O/c1-3-14-8-11(9(2)13-14)12-7-10-5-4-6-15-10/h4-6,8,12H,3,7H2,1-2H3
InChIKeyHJVUPELEARZVTE-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.42
Rot. Bonds4

About 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine

1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine (PubChem CID 19626815) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine
PubChem CID19626815
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine
SMILESCCn1cc(NCc2ccco2)c(C)n1
InChIInChI=1S/C11H15N3O/c1-3-14-8-11(9(2)13-14)12-7-10-5-4-6-15-10/h4-6,8,12H,3,7H2,1-2H3
InChIKeyHJVUPELEARZVTE-UHFFFAOYSA-N
XLogP2.42
TPSA42.99 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 ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-1-ethyl-3-methylpyrazol-4-amine;hydrochloride
CID 126964772
1-N-(1-ethyl-3-methylpyrazol-4-yl)-4-N-(furan-2-ylmethyl)piperidine-1,4-dicarboxamide
CID 72918464
2-[[(1-ethyl-3-methylpyrazol-4-yl)amino]methyl]benzoic acid;hydrochloride
CID 126966296
2-ethyl-N-(furan-2-ylmethyl)-5-methylpyrazol-3-amine
CID 122168955
2-fluoro-N-(furan-2-ylmethyl)-3-methylaniline
CID 115904329
1-ethyl-N-[1-ethyl-3-(furan-2-ylmethylcarbamoyl)pyrazol-4-yl]-3,5-dimethylpyrazole-4-carboxamide
CID 19472207
1-[(4-bromo-1-ethylpyrazol-3-yl)methyl]-3-(furan-2-ylmethyl)thiourea
CID 19571998
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-3-methyl-1-propylpyrazol-4-amine
CID 122167189
N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride
CID 126966130
1-ethyl-N-(furan-2-ylmethyl)-4-[(2-methylbenzoyl)amino]pyrazole-3-carboxamide
CID 19400381
1-ethyl-N-(furan-2-ylmethyl)-4-[[2-(3-methylpyrazol-1-yl)acetyl]amino]pyrazole-3-carboxamide
CID 19516989
(5S)-3-(1-ethyl-3-methylpyrazol-4-yl)-N-(furan-2-ylmethyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 40642816

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine?
The IUPAC name of 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine (CID 19626815) is 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine.
What is the SMILES notation for 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine?
The canonical SMILES for 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine is CCn1cc(NCc2ccco2)c(C)n1.
What is the InChIKey of 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine?
The InChIKey is HJVUPELEARZVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-3-14-8-11(9(2)13-14)12-7-10-5-4-6-15-10/h4-6,8,12H,3,7H2,1-2H3.
What are the key properties of 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine?
1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine has a molecular weight of 205.26 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine is sourced from PubChem (CID 19626815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).