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

C12H14N4O2 — CID 62075964

IUPAC4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide
SMILESNc1c(C(=O)NCc2ccco2)n[nH]c1C1CC1
InChIInChI=1S/C12H14N4O2/c13-9-10(7-3-4-7)15-16-11(9)12(17)14-6-8-2-1-5-18-8/h1-2,5,7H,3-4,6,13H2,(H,14,17)(H,15,16)
InChIKeySYQHKKYAZMZURH-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.39
Rot. Bonds4

About 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide

4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide (PubChem CID 62075964) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide
PubChem CID62075964
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide
SMILESNc1c(C(=O)NCc2ccco2)n[nH]c1C1CC1
InChIInChI=1S/C12H14N4O2/c13-9-10(7-3-4-7)15-16-11(9)12(17)14-6-8-2-1-5-18-8/h1-2,5,7H,3-4,6,13H2,(H,14,17)(H,15,16)
InChIKeySYQHKKYAZMZURH-UHFFFAOYSA-N
XLogP1.39
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-N-(furan-2-ylmethyl)-2H-triazole-4-carboxamide
CID 110484783
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CID 65467132
4-amino-N-[2-(5-bromothiophen-2-yl)ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide
CID 106033606
4-amino-5-cyclopropyl-N-[2-(ethylamino)-2-oxoethyl]-1H-pyrazole-3-carboxamide
CID 62078792
5-amino-N-(furan-2-ylmethyl)isoquinoline-1-carboxamide
CID 82571771
4-amino-5-cyclopropyl-N-(4-ethylphenyl)-1H-pyrazole-3-carboxamide
CID 62077284
N-(furan-2-ylmethyl)-5-[(3S)-oxolan-3-yl]-1H-pyrazole-4-carboxamide
CID 129472298
4-amino-N-(2-chloropyrimidin-4-yl)-5-cyclopropyl-1H-pyrazole-3-carboxamide
CID 116794674
6-amino-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 62156387
4-amino-5-cyclopropyl-N-[2-(dimethylsulfamoyl)ethyl]-1H-pyrazole-3-carboxamide
CID 106333015
3-(4-fluorophenyl)-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
CID 19514521
4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide
CID 55034313

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide (CID 62075964) is 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide is Nc1c(C(=O)NCc2ccco2)n[nH]c1C1CC1.
What is the InChIKey of 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide?
The InChIKey is SYQHKKYAZMZURH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c13-9-10(7-3-4-7)15-16-11(9)12(17)14-6-8-2-1-5-18-8/h1-2,5,7H,3-4,6,13H2,(H,14,17)(H,15,16).
What are the key properties of 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 1.39, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyclopropyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62075964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).