N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide

C22H19F2N5O2 — CID 152678422

IUPACN-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide
SMILES[2H]C([2H])([2H])Oc1ccc2c(n1)C=C(c1cccc(C(F)F)n1)C(c1ccnc(NC(C)=O)c1)N2
InChIInChI=1S/C22H19F2N5O2/c1-12(30)26-19-10-13(8-9-25-19)21-14(15-4-3-5-17(27-15)22(23)24)11-18-16(29-21)6-7-20(28-18)31-2/h3-11,21-22,29H,1-2H3,(H,25,26,30)/i2D3
InChIKeyZMZWALMMOMMVMG-BMSJAHLVSA-N
MW426.44 g/mol
LogP4.48
Rot. Bonds6

About N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide

N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide (PubChem CID 152678422) has the molecular formula C22H19F2N5O2 and a molecular weight of 426.44 g/mol. Its IUPAC name is N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide
PubChem CID152678422
Molecular FormulaC22H19F2N5O2
Molecular Weight426.44 g/mol
Exact Mass426.17
IUPAC NameN-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide
SMILES[2H]C([2H])([2H])Oc1ccc2c(n1)C=C(c1cccc(C(F)F)n1)C(c1ccnc(NC(C)=O)c1)N2
InChIInChI=1S/C22H19F2N5O2/c1-12(30)26-19-10-13(8-9-25-19)21-14(15-4-3-5-17(27-15)22(23)24)11-18-16(29-21)6-7-20(28-18)31-2/h3-11,21-22,29H,1-2H3,(H,25,26,30)/i2D3
InChIKeyZMZWALMMOMMVMG-BMSJAHLVSA-N
XLogP4.48
TPSA89.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.44
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-7-methoxy-1H-pyrrolo[3,2-b]pyridin-2-yl]-2-pyridinyl]acetamide
CID 121411995
N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-7-(fluoromethyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]-2-pyridinyl]acetamide
CID 121411779
N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-7-(2-pyrrolidin-1-ylethoxy)-1-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-b]pyridin-2-yl]-2-pyridinyl]acetamide
CID 140726683
N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-7-(hydroxymethyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-b]pyridin-2-yl]-2-pyridinyl]acetamide
CID 140726703
N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-5-fluoro-2-pyridinyl]acetamide
CID 126537574
fluoro N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-2-pyridinyl]carbamate
CID 126537729
[4-[[2-[6-(difluoromethyl)-2-pyridinyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-2-pyridinyl]carbamic acid
CID 126537727
N-[4-(3-fluorophenoxy)-2-pyridinyl]acetamide
CID 141205782
N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]-5-[[(2-hydroxy-2-methylpropyl)amino]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-5-fluoro-2-pyridinyl]acetamide
CID 126537741
N-(4-pyridin-2-yl-2-pyridinyl)acetamide
CID 22601790
2-acetamido-N-[[5-cyclopropyl-6-(2,2-difluoroethoxy)-3-pyridinyl]methyl]pyridine-4-carboxamide
CID 87426751
N-(2-cyclopropyl-8-methoxyimidazo[1,2-a]pyrazin-6-yl)-6-(difluoromethyl)pyridine-2-carboxamide
CID 154655470

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide (CID 152678422) is N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide is [2H]C([2H])([2H])Oc1ccc2c(n1)C=C(c1cccc(C(F)F)n1)C(c1ccnc(NC(C)=O)c1)N2.
What is the InChIKey of N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide?
The InChIKey is ZMZWALMMOMMVMG-BMSJAHLVSA-N. The full InChI is InChI=1S/C22H19F2N5O2/c1-12(30)26-19-10-13(8-9-25-19)21-14(15-4-3-5-17(27-15)22(23)24)11-18-16(29-21)6-7-20(28-18)31-2/h3-11,21-22,29H,1-2H3,(H,25,26,30)/i2D3.
What are the key properties of N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide?
N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide has a molecular weight of 426.44 g/mol, XLogP of 4.48, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-[6-(difluoromethyl)-2-pyridinyl]-6-(trideuteriomethoxy)-1,2-dihydro-1,5-naphthyridin-2-yl]-2-pyridinyl]acetamide is sourced from PubChem (CID 152678422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).