2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide

C17H23N3O2 — CID 122265953

IUPAC2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
SMILESO=C(CC1CCCCC1)NCC(c1ccco1)n1cccn1
InChIInChI=1S/C17H23N3O2/c21-17(12-14-6-2-1-3-7-14)18-13-15(16-8-4-11-22-16)20-10-5-9-19-20/h4-5,8-11,14-15H,1-3,6-7,12-13H2,(H,18,21)
InChIKeyQKZVQLRRMSJIFN-UHFFFAOYSA-N
MW301.39 g/mol
LogP3.15
Rot. Bonds6

About 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide

2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide (PubChem CID 122265953) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
PubChem CID122265953
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
SMILESO=C(CC1CCCCC1)NCC(c1ccco1)n1cccn1
InChIInChI=1S/C17H23N3O2/c21-17(12-14-6-2-1-3-7-14)18-13-15(16-8-4-11-22-16)20-10-5-9-19-20/h4-5,8-11,14-15H,1-3,6-7,12-13H2,(H,18,21)
InChIKeyQKZVQLRRMSJIFN-UHFFFAOYSA-N
XLogP3.15
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclohexanecarboxamide
CID 122265946
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide
CID 122265941
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-3-methylbutanamide
CID 122265939
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]oxane-4-carboxamide
CID 121019365
2-ethoxy-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
CID 122265940
N-(furan-2-ylmethyl)-N'-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]oxamide
CID 122266212
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide
CID 122266052
2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
CID 122266032
2,6-difluoro-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]benzamide
CID 122265973
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-N'-(4-methylphenyl)oxamide
CID 122266215
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-1,3-benzodioxole-5-carboxamide
CID 121019350
N'-(2-chlorophenyl)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]oxamide
CID 119102102

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide?
The IUPAC name of 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide (CID 122265953) is 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide.
What is the SMILES notation for 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide?
The canonical SMILES for 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide is O=C(CC1CCCCC1)NCC(c1ccco1)n1cccn1.
What is the InChIKey of 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide?
The InChIKey is QKZVQLRRMSJIFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c21-17(12-14-6-2-1-3-7-14)18-13-15(16-8-4-11-22-16)20-10-5-9-19-20/h4-5,8-11,14-15H,1-3,6-7,12-13H2,(H,18,21).
What are the key properties of 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide?
2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide has a molecular weight of 301.39 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide is sourced from PubChem (CID 122265953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).