1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine

C15H19N5O — CID 19627676

IUPAC1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine
SMILESCCn1ccc(C(C)NCc2cc(-c3ccco3)n[nH]2)n1
InChIInChI=1S/C15H19N5O/c1-3-20-7-6-13(19-20)11(2)16-10-12-9-14(18-17-12)15-5-4-8-21-15/h4-9,11,16H,3,10H2,1-2H3,(H,17,18)
InChIKeyUHMBHKRUDDNELF-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.74
Rot. Bonds6

About 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine

1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine (PubChem CID 19627676) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine.

Molecular Properties

Compound Name1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine
PubChem CID19627676
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine
SMILESCCn1ccc(C(C)NCc2cc(-c3ccco3)n[nH]2)n1
InChIInChI=1S/C15H19N5O/c1-3-20-7-6-13(19-20)11(2)16-10-12-9-14(18-17-12)15-5-4-8-21-15/h4-9,11,16H,3,10H2,1-2H3,(H,17,18)
InChIKeyUHMBHKRUDDNELF-UHFFFAOYSA-N
XLogP2.74
TPSA71.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[3-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]methanamine
CID 16190066
N-(furan-2-ylmethyl)-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide
CID 5307834
1-[3-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]methanamine
CID 16190191
1-(4-fluorophenyl)-4-{[5-(1H-pyrazol-3-yl)-2-furyl]methyl}-1,4-diazepane
CID 56884532
1-[1-(3-fluorophenyl)-3-(5-methyl-2-furyl)-1H-pyrazol-4-yl]-N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]methanamine
CID 70783527
(S)-N-(1-(3-(4-cyano-3-methylphenyl)-1H-pyrazol-1-yl)propan-2-yl)-3-(furan-2-yl)-1H-pyrazole-5-carboxamide
CID 52919708
US11026923, Example 202
CID 155773327
N-[2-(dimethylamino)ethyl]-2-[5-(furan-2-yl)-3-methylpyrazol-1-yl]acetamide
CID 5308038
1-[(3-methylpyridin-2-yl)methyl]-4-{[5-(1H-pyrazol-3-yl)-2-furyl]methyl}piperazine
CID 50953242
N-[[5-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]methyl]-2-pyrazol-1-ylethanamine
CID 53536230
[5-(furan-2-yl)-1H-pyrazol-3-yl]-[3-(4-methylpyrazol-1-yl)piperidin-1-yl]methanone
CID 53566927
(2S,4S)-4-amino-N-ethyl-1-{[5-(1H-pyrazol-3-yl)-2-furyl]methyl}pyrrolidine-2-carboxamide
CID 56709916

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine?
The IUPAC name of 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine (CID 19627676) is 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine.
What is the SMILES notation for 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine?
The canonical SMILES for 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine is CCn1ccc(C(C)NCc2cc(-c3ccco3)n[nH]2)n1.
What is the InChIKey of 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine?
The InChIKey is UHMBHKRUDDNELF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-3-20-7-6-13(19-20)11(2)16-10-12-9-14(18-17-12)15-5-4-8-21-15/h4-9,11,16H,3,10H2,1-2H3,(H,17,18).
What are the key properties of 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine?
1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine has a molecular weight of 285.35 g/mol, XLogP of 2.74, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpyrazol-3-yl)-N-[[3-(furan-2-yl)-1H-pyrazol-5-yl]methyl]ethanamine is sourced from PubChem (CID 19627676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).