3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide

C11H14N4O2 — CID 64525222

IUPAC3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
SMILESCCN(Cc1ccco1)C(=O)c1cc(N)n[nH]1
InChIInChI=1S/C11H14N4O2/c1-2-15(7-8-4-3-5-17-8)11(16)9-6-10(12)14-13-9/h3-6H,2,7H2,1H3,(H3,12,13,14)
InChIKeyYNQBCHIPOMEGLS-UHFFFAOYSA-N
MW234.26 g/mol
LogP1.25
Rot. Bonds4

About 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide

3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide (PubChem CID 64525222) has the molecular formula C11H14N4O2 and a molecular weight of 234.26 g/mol. Its IUPAC name is 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
PubChem CID64525222
Molecular FormulaC11H14N4O2
Molecular Weight234.26 g/mol
Exact Mass234.11
IUPAC Name3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
SMILESCCN(Cc1ccco1)C(=O)c1cc(N)n[nH]1
InChIInChI=1S/C11H14N4O2/c1-2-15(7-8-4-3-5-17-8)11(16)9-6-10(12)14-13-9/h3-6H,2,7H2,1H3,(H3,12,13,14)
InChIKeyYNQBCHIPOMEGLS-UHFFFAOYSA-N
XLogP1.25
TPSA88.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-cyclopentyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
CID 64524441
5-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-indole-2-carboxamide
CID 62056822
4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(furan-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 116663180
2-amino-6-ethoxy-N-ethyl-N-(furan-2-ylmethyl)benzamide
CID 81394645
2-amino-N-ethyl-N-(furan-2-ylmethyl)-1,3-benzothiazole-6-carboxamide
CID 65349536
2-(2-aminophenoxy)-N-ethyl-N-(furan-2-ylmethyl)acetamide
CID 61110180
5-chloro-N-ethyl-N-(furan-2-ylmethyl)-1H-indole-2-carboxamide
CID 47024404
N-ethyl-N-(furan-2-ylmethyl)-3-hydroxybenzamide
CID 61421066
1-ethyl-1-(furan-2-ylmethyl)-3,3-dimethylurea
CID 115581572
N-ethyl-N-(furan-2-ylmethyl)-3-sulfanylbenzamide
CID 107024394
N-ethyl-N-(furan-2-ylmethyl)-3-hydroxypyridine-2-carboxamide
CID 61421116
3-amino-5-ethoxy-N-ethyl-N-(furan-2-ylmethyl)benzamide
CID 81093317

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide (CID 64525222) is 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide is CCN(Cc1ccco1)C(=O)c1cc(N)n[nH]1.
What is the InChIKey of 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide?
The InChIKey is YNQBCHIPOMEGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2/c1-2-15(7-8-4-3-5-17-8)11(16)9-6-10(12)14-13-9/h3-6H,2,7H2,1H3,(H3,12,13,14).
What are the key properties of 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide?
3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide has a molecular weight of 234.26 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 64525222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).