N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide

C19H32N4O3 — CID 119643420

About N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide

N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide (PubChem CID 119643420) has the molecular formula C19H32N4O3 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide
• PubChem CID: 119643420
• Molecular Formula: C19H32N4O3
• Molecular Weight: 364.49 g/mol
• Exact Mass: 364.25
• IUPAC Name: N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide
• SMILES: CCC(N)(CC)CNC(=O)c1c(C)cc(=O)n(CC(=O)NC(C)C)c1C
• InChI: InChI=1S/C19H32N4O3/c1-7-19(20,8-2)11-21-18(26)17-13(5)9-16(25)23(14(17)6)10-15(24)22-12(3)4/h9,12H,7-8,10-11,20H2,1-6H3,(H,21,26)(H,22,24)
• InChIKey: NKXDCPMAYVZZIQ-UHFFFAOYSA-N
• XLogP: 1.24
• TPSA: 106.22 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	364.49
LogP ≤ 5	1.24
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide?

The IUPAC name of N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide (CID 119643420) is N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide.

What is the SMILES notation for N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide?

The canonical SMILES for N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide is CCC(N)(CC)CNC(=O)c1c(C)cc(=O)n(CC(=O)NC(C)C)c1C.

What is the InChIKey of N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide?

The InChIKey is NKXDCPMAYVZZIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N4O3/c1-7-19(20,8-2)11-21-18(26)17-13(5)9-16(25)23(14(17)6)10-15(24)22-12(3)4/h9,12H,7-8,10-11,20H2,1-6H3,(H,21,26)(H,22,24).

What are the key properties of N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide?

N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 1.24, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-amino-2-ethylbutyl)-2,4-dimethyl-6-oxo-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 119643420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).