6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide

C19H26N6O6 — CID 73443015

About 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide

6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide (PubChem CID 73443015) has the molecular formula C19H26N6O6 and a molecular weight of 434.45 g/mol. Its IUPAC name is 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide
• PubChem CID: 73443015
• Molecular Formula: C19H26N6O6
• Molecular Weight: 434.45 g/mol
• Exact Mass: 434.19
• IUPAC Name: 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide
• SMILES: Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n(CCCNC(=O)c2ccc(NN)nc2)c1=O
• InChI: InChI=1S/C19H26N6O6/c1-11-9-25(16-7-13(27)14(10-26)31-16)19(30)24(18(11)29)6-2-5-21-17(28)12-3-4-15(23-20)22-8-12/h3-4,8-9,13-14,16,26-27H,2,5-7,10,20H2,1H3,(H,21,28)(H,22,23)/t13-,14+,16+/m0/s1
• InChIKey: SFXPFXGCGQUHSI-SQWLQELKSA-N
• XLogP: -1.54
• TPSA: 173.73 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 11
• Rotatable Bonds: 8
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	434.45
LogP ≤ 5	-1.54
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide?

The IUPAC name of 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide (CID 73443015) is 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide.

What is the SMILES notation for 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide?

The canonical SMILES for 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide is Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n(CCCNC(=O)c2ccc(NN)nc2)c1=O.

What is the InChIKey of 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide?

The InChIKey is SFXPFXGCGQUHSI-SQWLQELKSA-N. The full InChI is InChI=1S/C19H26N6O6/c1-11-9-25(16-7-13(27)14(10-26)31-16)19(30)24(18(11)29)6-2-5-21-17(28)12-3-4-15(23-20)22-8-12/h3-4,8-9,13-14,16,26-27H,2,5-7,10,20H2,1H3,(H,21,28)(H,22,23)/t13-,14+,16+/m0/s1.

What are the key properties of 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide?

6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide has a molecular weight of 434.45 g/mol, XLogP of -1.54, 8 rotatable bonds, 5 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 6-hydrazinyl-N-[3-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]propyl]pyridine-3-carboxamide is sourced from PubChem (CID 73443015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).