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

C13H16N4O2 — CID 55034313

IUPAC4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide
SMILESCN(Cc1ccoc1)C(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C13H16N4O2/c1-17(6-8-4-5-19-7-8)13(18)12-10(14)11(15-16-12)9-2-3-9/h4-5,7,9H,2-3,6,14H2,1H3,(H,15,16)
InChIKeyYEHKJQFOTCVSTI-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.73
Rot. Bonds4

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

4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide (PubChem CID 55034313) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide
PubChem CID55034313
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide
SMILESCN(Cc1ccoc1)C(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C13H16N4O2/c1-17(6-8-4-5-19-7-8)13(18)12-10(14)11(15-16-12)9-2-3-9/h4-5,7,9H,2-3,6,14H2,1H3,(H,15,16)
InChIKeyYEHKJQFOTCVSTI-UHFFFAOYSA-N
XLogP1.73
TPSA88.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 146102535
4-amino-N-butyl-5-cyclopropyl-N-methyl-1H-pyrazole-3-carboxamide
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4-amino-5-cyclopropyl-N-methyl-N-[3-(methylamino)-3-oxopropyl]-1H-pyrazole-3-carboxamide
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CID 102990884
4-amino-5-cyclopropyl-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-3-carboxamide
CID 62079532
4-amino-5-cyclopropyl-N-[2-[di(propan-2-yl)amino]ethyl]-1H-pyrazole-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide (CID 55034313) is 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide is CN(Cc1ccoc1)C(=O)c1n[nH]c(C2CC2)c1N.
What is the InChIKey of 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide?
The InChIKey is YEHKJQFOTCVSTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-17(6-8-4-5-19-7-8)13(18)12-10(14)11(15-16-12)9-2-3-9/h4-5,7,9H,2-3,6,14H2,1H3,(H,15,16).
What are the key properties of 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyclopropyl-N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 55034313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).