N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide

C19H17N5O4S — CID 71726622

IUPACN-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCCn1cc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)nc2)cn1
InChIInChI=1S/C19H17N5O4S/c1-2-24-12-16(10-23-24)29(26,27)15-4-3-14(21-9-15)8-22-19(25)17-7-13-5-6-20-11-18(13)28-17/h3-7,9-12H,2,8H2,1H3,(H,22,25)
InChIKeyULYRSPFAVXMBQH-UHFFFAOYSA-N
MW411.44 g/mol
LogP2.20
Rot. Bonds6

About N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide

N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 71726622) has the molecular formula C19H17N5O4S and a molecular weight of 411.44 g/mol. Its IUPAC name is N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID71726622
Molecular FormulaC19H17N5O4S
Molecular Weight411.44 g/mol
Exact Mass411.10
IUPAC NameN-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCCn1cc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)nc2)cn1
InChIInChI=1S/C19H17N5O4S/c1-2-24-12-16(10-23-24)29(26,27)15-4-3-14(21-9-15)8-22-19(25)17-7-13-5-6-20-11-18(13)28-17/h3-7,9-12H,2,8H2,1H3,(H,22,25)
InChIKeyULYRSPFAVXMBQH-UHFFFAOYSA-N
XLogP2.20
TPSA119.98 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.44
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 71726622) is N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide is CCn1cc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)nc2)cn1.
What is the InChIKey of N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is ULYRSPFAVXMBQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O4S/c1-2-24-12-16(10-23-24)29(26,27)15-4-3-14(21-9-15)8-22-19(25)17-7-13-5-6-20-11-18(13)28-17/h3-7,9-12H,2,8H2,1H3,(H,22,25).
What are the key properties of N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 411.44 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(1-ethylpyrazol-4-yl)sulfonyl-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 71726622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).