1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide

C21H30N4O3 — CID 172667783

About 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide

1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide (PubChem CID 172667783) has the molecular formula C21H30N4O3 and a molecular weight of 386.50 g/mol. Its IUPAC name is 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide.

Molecular Properties

• Compound Name: 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide
• PubChem CID: 172667783
• Molecular Formula: C21H30N4O3
• Molecular Weight: 386.50 g/mol
• Exact Mass: 386.23
• IUPAC Name: 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide
• SMILES: COc1c(C)cnc(CNC(=O)c2c(C)ccn(C(C)CN(C)C)c2=O)c1C
• InChI: InChI=1S/C21H30N4O3/c1-13-8-9-25(15(3)12-24(5)6)21(27)18(13)20(26)23-11-17-16(4)19(28-7)14(2)10-22-17/h8-10,15H,11-12H2,1-7H3,(H,23,26)
• InChIKey: HEXNWRIFXODTQC-UHFFFAOYSA-N
• XLogP: 2.23
• TPSA: 76.46 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	386.50
LogP ≤ 5	2.23
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide?

The IUPAC name of 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide (CID 172667783) is 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide.

What is the SMILES notation for 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide?

The canonical SMILES for 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide is COc1c(C)cnc(CNC(=O)c2c(C)ccn(C(C)CN(C)C)c2=O)c1C.

What is the InChIKey of 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide?

The InChIKey is HEXNWRIFXODTQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O3/c1-13-8-9-25(15(3)12-24(5)6)21(27)18(13)20(26)23-11-17-16(4)19(28-7)14(2)10-22-17/h8-10,15H,11-12H2,1-7H3,(H,23,26).

What are the key properties of 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide?

1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide has a molecular weight of 386.50 g/mol, XLogP of 2.23, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172667783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).