N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide

C19H21N3O — CID 59023498

About N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide

N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide (PubChem CID 59023498) has the molecular formula C19H21N3O and a molecular weight of 322.49 g/mol. Its IUPAC name is N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide.

Molecular Properties

• Compound Name: N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide
• PubChem CID: 59023498
• Molecular Formula: C19H21N3O
• Molecular Weight: 322.49 g/mol
• Exact Mass: 322.26
• IUPAC Name: N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide
• SMILES: [2H]c1c(C([2H])([2H])[2H])c([2H])n2c(CC(=O)N(C([2H])([2H])[2H])C([2H])([2H])[2H])c(-c3ccc(C([2H])([2H])[2H])cc3)nc2c1[2H]
• InChI: InChI=1S/C19H21N3O/c1-13-5-8-15(9-6-13)19-16(11-18(23)21(3)4)22-12-14(2)7-10-17(22)20-19/h5-10,12H,11H2,1-4H3/i1D3,2D3,3D3,4D3,7D,10D,12D
• InChIKey: ZAFYATHCZYHLPB-HNDMIWATSA-N
• XLogP: 3.25
• TPSA: 37.61 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 7
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	322.49
LogP ≤ 5	3.25
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide?

The IUPAC name of N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide (CID 59023498) is N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide.

What is the SMILES notation for N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide?

The canonical SMILES for N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide is [2H]c1c(C([2H])([2H])[2H])c([2H])n2c(CC(=O)N(C([2H])([2H])[2H])C([2H])([2H])[2H])c(-c3ccc(C([2H])([2H])[2H])cc3)nc2c1[2H].

What is the InChIKey of N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide?

The InChIKey is ZAFYATHCZYHLPB-HNDMIWATSA-N. The full InChI is InChI=1S/C19H21N3O/c1-13-5-8-15(9-6-13)19-16(11-18(23)21(3)4)22-12-14(2)7-10-17(22)20-19/h5-10,12H,11H2,1-4H3/i1D3,2D3,3D3,4D3,7D,10D,12D.

What are the key properties of N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide?

N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide has a molecular weight of 322.49 g/mol, XLogP of 3.25, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-bis(trideuteriomethyl)-2-[5,7,8-trideuterio-6-(trideuteriomethyl)-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]acetamide is sourced from PubChem (CID 59023498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).