N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide

C18H20N4O3 — CID 91153416

IUPACN-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide
SMILESCC(C)C(=O)Nc1nn(C(=O)C(C)C)c2cc(-c3ccco3)ncc12
InChIInChI=1S/C18H20N4O3/c1-10(2)17(23)20-16-12-9-19-13(15-6-5-7-25-15)8-14(12)22(21-16)18(24)11(3)4/h5-11H,1-4H3,(H,20,21,23)
InChIKeyLMQKLFNYYWMLPH-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.58
Rot. Bonds4

About N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide

N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide (PubChem CID 91153416) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide
PubChem CID91153416
Molecular FormulaC18H20N4O3
Molecular Weight340.38 g/mol
Exact Mass340.15
IUPAC NameN-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide
SMILESCC(C)C(=O)Nc1nn(C(=O)C(C)C)c2cc(-c3ccco3)ncc12
InChIInChI=1S/C18H20N4O3/c1-10(2)17(23)20-16-12-9-19-13(15-6-5-7-25-15)8-14(12)22(21-16)18(24)11(3)4/h5-11H,1-4H3,(H,20,21,23)
InChIKeyLMQKLFNYYWMLPH-UHFFFAOYSA-N
XLogP3.58
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide?
The IUPAC name of N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide (CID 91153416) is N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide.
What is the SMILES notation for N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide?
The canonical SMILES for N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide is CC(C)C(=O)Nc1nn(C(=O)C(C)C)c2cc(-c3ccco3)ncc12.
What is the InChIKey of N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide?
The InChIKey is LMQKLFNYYWMLPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3/c1-10(2)17(23)20-16-12-9-19-13(15-6-5-7-25-15)8-14(12)22(21-16)18(24)11(3)4/h5-11H,1-4H3,(H,20,21,23).
What are the key properties of N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide?
N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide has a molecular weight of 340.38 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(furan-2-yl)-1-(2-methylpropanoyl)pyrazolo[4,3-c]pyridin-3-yl]-2-methylpropanamide is sourced from PubChem (CID 91153416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).