N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide

C23H24N6O3 — CID 11350961

IUPACN-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide
SMILESCCOC(C(=O)NCc1ccc2c(N)n[nH]c2c1)n1cccc(Nc2ccccc2)c1=O
InChIInChI=1S/C23H24N6O3/c1-2-32-23(21(30)25-14-15-10-11-17-19(13-15)27-28-20(17)24)29-12-6-9-18(22(29)31)26-16-7-4-3-5-8-16/h3-13,23,26H,2,14H2,1H3,(H,25,30)(H3,24,27,28)
InChIKeyVLWZQPPFELODOB-UHFFFAOYSA-N
MW432.48 g/mol
LogP2.90
Rot. Bonds8

About N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide

N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide (PubChem CID 11350961) has the molecular formula C23H24N6O3 and a molecular weight of 432.48 g/mol. Its IUPAC name is N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide.

Molecular Properties

Compound NameN-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide
PubChem CID11350961
Molecular FormulaC23H24N6O3
Molecular Weight432.48 g/mol
Exact Mass432.19
IUPAC NameN-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide
SMILESCCOC(C(=O)NCc1ccc2c(N)n[nH]c2c1)n1cccc(Nc2ccccc2)c1=O
InChIInChI=1S/C23H24N6O3/c1-2-32-23(21(30)25-14-15-10-11-17-19(13-15)27-28-20(17)24)29-12-6-9-18(22(29)31)26-16-7-4-3-5-8-16/h3-13,23,26H,2,14H2,1H3,(H,25,30)(H3,24,27,28)
InChIKeyVLWZQPPFELODOB-UHFFFAOYSA-N
XLogP2.90
TPSA127.06 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.48
LogP ≤ 52.90
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide with MolForge

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Launch Full Analysis

Related Compounds

2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxy-N-[[3-fluoro-4-[(Z)-N'-hydroxycarbamimidoyl]phenyl]methyl]acetamide
CID 11316953
2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetic acid
CID 22064713
2-(3-anilino-2-oxo-1-pyridinyl)-N-[(4-carbamimidoyl-2,6-difluorophenyl)methyl]-2-ethoxyacetamide
CID 11226076
(2S)-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxy-N-[[2-fluoro-4-(N'-hydroxycarbamimidoyl)phenyl]methyl]acetamide
CID 173196491
N-[[2-(2-amino-2-oxoethoxy)-4-(N'-hydroxycarbamimidoyl)phenyl]methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide
CID 72758784
(3-amino-1H-indazol-6-yl) N-[(3-chlorophenyl)methyl]carbamate
CID 68886644
(2R,4R)-N-[(2S)-1-[(3-amino-1H-indazol-6-yl)methylamino]-1-oxopropan-2-yl]-4-phenylpyrrolidine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 175888455
(2S)-2-methoxy-N-[(2-methyl-3H-benzimidazol-5-yl)methyl]-2-phenylacetamide
CID 99995565
[(2S)-1-[(3-amino-1H-indazol-6-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid
CID 142702656
ethyl 2-[[2-[3-[(4-amino-3-chlorobenzoyl)amino]-2-oxo-1-pyridinyl]propanoylamino]-[(E)-4-(benzylamino)-4-oxobut-2-enoyl]amino]acetate
CID 170382208
N-[(4-carbamimidoylphenyl)methyl]-2-(1,3-dioxoisoindol-2-yl)-2-ethoxyacetamide
CID 11282109
bis(5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione);ethyl 3-anilino-4-oxo-1H-quinoline-2-carboxylate;2,2,2-trichloro-N-[[6,12-dioxo-2-[[(2,2,2-trichloroacetyl)amino]methyl]-5,11-dihydroquinolino[3,2-b]quinolin-8-yl]methyl]acetamide
CID 157083076

Frequently Asked Questions

What is the IUPAC name of N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide?
The IUPAC name of N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide (CID 11350961) is N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide.
What is the SMILES notation for N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide?
The canonical SMILES for N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide is CCOC(C(=O)NCc1ccc2c(N)n[nH]c2c1)n1cccc(Nc2ccccc2)c1=O.
What is the InChIKey of N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide?
The InChIKey is VLWZQPPFELODOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O3/c1-2-32-23(21(30)25-14-15-10-11-17-19(13-15)27-28-20(17)24)29-12-6-9-18(22(29)31)26-16-7-4-3-5-8-16/h3-13,23,26H,2,14H2,1H3,(H,25,30)(H3,24,27,28).
What are the key properties of N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide?
N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide has a molecular weight of 432.48 g/mol, XLogP of 2.90, 8 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-amino-1H-indazol-6-yl)methyl]-2-(3-anilino-2-oxo-1-pyridinyl)-2-ethoxyacetamide is sourced from PubChem (CID 11350961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).