5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide

C19H20N4O3 — CID 42095333

About 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide

5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide (PubChem CID 42095333) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide.

Molecular Properties

• Compound Name: 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide
• PubChem CID: 42095333
• Molecular Formula: C19H20N4O3
• Molecular Weight: 352.39 g/mol
• Exact Mass: 352.15
• IUPAC Name: 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide
• SMILES: COCc1ccc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccn2)o1
• InChI: InChI=1S/C19H20N4O3/c1-25-12-13-8-9-17(26-13)19(24)22-15-5-4-6-16-14(15)11-21-23(16)18-7-2-3-10-20-18/h2-3,7-11,15H,4-6,12H2,1H3,(H,22,24)/t15-/m0/s1
• InChIKey: WJJBBAXEGASNGC-HNNXBMFYSA-N
• XLogP: 2.81
• TPSA: 82.18 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	352.39
LogP ≤ 5	2.81
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide?

The IUPAC name of 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide (CID 42095333) is 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide.

What is the SMILES notation for 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide?

The canonical SMILES for 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide is COCc1ccc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccn2)o1.

What is the InChIKey of 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide?

The InChIKey is WJJBBAXEGASNGC-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-25-12-13-8-9-17(26-13)19(24)22-15-5-4-6-16-14(15)11-21-23(16)18-7-2-3-10-20-18/h2-3,7-11,15H,4-6,12H2,1H3,(H,22,24)/t15-/m0/s1.

What are the key properties of 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide?

5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(methoxymethyl)-N-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide is sourced from PubChem (CID 42095333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).