N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide

C10H11N3O2 — CID 103855985

IUPACN-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide
SMILESCC(NC(=O)c1ccco1)c1cn[nH]c1
InChIInChI=1S/C10H11N3O2/c1-7(8-5-11-12-6-8)13-10(14)9-3-2-4-15-9/h2-7H,1H3,(H,11,12)(H,13,14)
InChIKeyPWENRBIIRKQPMD-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.49
Rot. Bonds3

About N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide

N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide (PubChem CID 103855985) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide
PubChem CID103855985
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC NameN-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide
SMILESCC(NC(=O)c1ccco1)c1cn[nH]c1
InChIInChI=1S/C10H11N3O2/c1-7(8-5-11-12-6-8)13-10(14)9-3-2-4-15-9/h2-7H,1H3,(H,11,12)(H,13,14)
InChIKeyPWENRBIIRKQPMD-UHFFFAOYSA-N
XLogP1.49
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide
CID 103855919
N-[1-(4-bromophenyl)ethyl]furan-2-carboxamide
CID 2919180
2-hydroxy-N-[1-(1H-pyrazol-4-yl)ethyl]benzamide
CID 103857029
4-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]benzamide
CID 106218102
N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]furan-2-carboxamide
CID 35276451
3-phenyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-5-carboxamide
CID 103856479
2,6-dichloro-N-[1-(1H-pyrazol-4-yl)ethyl]benzamide
CID 103856631
3-(2-aminoethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]benzamide
CID 106217042
N-(1-thiophen-3-ylethyl)furan-2-carboxamide
CID 64590791
2,3-difluoro-N-[1-(1H-pyrazol-4-yl)ethyl]benzamide
CID 103856738
N-[1-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]furan-2-carboxamide
CID 4829465
3,6-dimethyl-2-[1-(1H-pyrazol-4-yl)ethylcarbamoyl]benzoic acid
CID 106208660

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide?
The IUPAC name of N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide (CID 103855985) is N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide is CC(NC(=O)c1ccco1)c1cn[nH]c1.
What is the InChIKey of N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide?
The InChIKey is PWENRBIIRKQPMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-7(8-5-11-12-6-8)13-10(14)9-3-2-4-15-9/h2-7H,1H3,(H,11,12)(H,13,14).
What are the key properties of N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide?
N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide has a molecular weight of 205.22 g/mol, XLogP of 1.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 103855985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).