N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide

C10H12N4O2 — CID 79530310

IUPACN-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide
SMILESCc1ccoc1C(=O)NCc1cn[nH]c1N
InChIInChI=1S/C10H12N4O2/c1-6-2-3-16-8(6)10(15)12-4-7-5-13-14-9(7)11/h2-3,5H,4H2,1H3,(H,12,15)(H3,11,13,14)
InChIKeyZJKIEULLLVNWNE-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.82
Rot. Bonds3

About N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide

N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide (PubChem CID 79530310) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide
PubChem CID79530310
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC NameN-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide
SMILESCc1ccoc1C(=O)NCc1cn[nH]c1N
InChIInChI=1S/C10H12N4O2/c1-6-2-3-16-8(6)10(15)12-4-7-5-13-14-9(7)11/h2-3,5H,4H2,1H3,(H,12,15)(H3,11,13,14)
InChIKeyZJKIEULLLVNWNE-UHFFFAOYSA-N
XLogP0.82
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-chlorofuran-3-carboxamide
CID 106688560
N-[(5-amino-1H-pyrazol-4-yl)methyl]-4-hydroxybenzamide
CID 79529688
N-[(5-amino-1H-pyrazol-4-yl)methyl]-5-methyl-1H-pyrazole-3-carboxamide
CID 79531339
N-[(5-amino-1H-pyrazol-4-yl)methyl]-4-chlorobenzamide
CID 79530127
N-[(5-amino-1H-pyrazol-4-yl)methyl]-3,4-dichlorobenzamide
CID 79530307
N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-methyl-4-nitrobenzamide
CID 79530745
N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-methyl-6-nitrobenzamide
CID 79530886
N-[(5-amino-1H-pyrazol-4-yl)methyl]-2,2-dimethylpropanamide
CID 79529836
1-[(5-amino-1H-pyrazol-4-yl)methyl]-3-(4-methylphenyl)urea
CID 79529401
N-[(5-amino-1H-pyrazol-4-yl)methyl]thiadiazole-5-carboxamide
CID 79531188
N-[(5-amino-1H-pyrazol-4-yl)methyl]-3,5-dibromobenzamide
CID 114022797
N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide
CID 79529546

Frequently Asked Questions

What is the IUPAC name of N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide?
The IUPAC name of N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide (CID 79530310) is N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide.
What is the SMILES notation for N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide?
The canonical SMILES for N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide is Cc1ccoc1C(=O)NCc1cn[nH]c1N.
What is the InChIKey of N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide?
The InChIKey is ZJKIEULLLVNWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-6-2-3-16-8(6)10(15)12-4-7-5-13-14-9(7)11/h2-3,5H,4H2,1H3,(H,12,15)(H3,11,13,14).
What are the key properties of N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide?
N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide has a molecular weight of 220.23 g/mol, XLogP of 0.82, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-amino-1H-pyrazol-4-yl)methyl]-3-methylfuran-2-carboxamide is sourced from PubChem (CID 79530310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).