N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide

C27H34N4O2Si — CID 167374759

IUPACN-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide
SMILESCc1cc2c(ccn2COCC[Si](C)(C)C)cc1-c1cc2cc(NC(=O)C3CC3)ncc2n1C
InChIInChI=1S/C27H34N4O2Si/c1-18-12-23-20(8-9-31(23)17-33-10-11-34(3,4)5)13-22(18)24-14-21-15-26(28-16-25(21)30(24)2)29-27(32)19-6-7-19/h8-9,12-16,19H,6-7,10-11,17H2,1-5H3,(H,28,29,32)
InChIKeyHCQNBSANRATKGO-UHFFFAOYSA-N
MW474.68 g/mol
LogP6.16
Rot. Bonds8

About N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide

N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide (PubChem CID 167374759) has the molecular formula C27H34N4O2Si and a molecular weight of 474.68 g/mol. Its IUPAC name is N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide
PubChem CID167374759
Molecular FormulaC27H34N4O2Si
Molecular Weight474.68 g/mol
Exact Mass474.25
IUPAC NameN-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide
SMILESCc1cc2c(ccn2COCC[Si](C)(C)C)cc1-c1cc2cc(NC(=O)C3CC3)ncc2n1C
InChIInChI=1S/C27H34N4O2Si/c1-18-12-23-20(8-9-31(23)17-33-10-11-34(3,4)5)13-22(18)24-14-21-15-26(28-16-25(21)30(24)2)29-27(32)19-6-7-19/h8-9,12-16,19H,6-7,10-11,17H2,1-5H3,(H,28,29,32)
InChIKeyHCQNBSANRATKGO-UHFFFAOYSA-N
XLogP6.16
TPSA61.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.68
LogP ≤ 56.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

N-[1-methyl-2-[4-methyl-1-(2-trimethylsilylethoxymethyl)indazol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide
CID 167374682
N-[8-oxo-7-(2-trimethylsilylethoxymethyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 178122976
N-[2-(2,4-dimethylphenyl)-1-methylpyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide
CID 170233143
N-[2-(2-isocyanophenyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide
CID 167374731
N-[2-(4,6-dimethoxypyrimidin-5-yl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide;methanol
CID 163252783
N-[3-(2-methylphenyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-6-yl]cyclopropanecarboxamide
CID 163251034
N-[2-[3-[6-[5-(cyclopropanecarbonylamino)-1-methylpyrrolo[2,3-c]pyridin-2-yl]-5-methyl-3H-benzimidazol-1-ium-1-yl]-4-methyl-1H-indazol-5-yl]-1-methylpyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide
CID 163252798
N-[5-(6-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-8-oxo-7-(2-trimethylsilylethoxymethyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 178122048
N-[5-[6-(4,4-difluoropiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-8-oxo-7-(2-trimethylsilylethoxymethyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 178122499
N-[3-[6-(2-methoxyacetyl)-4-methyl-3-pyridinyl]-1-methyl-2-oxo-1,6-naphthyridin-7-yl]cyclopropanecarboxamide
CID 166123675
N-[3-(3-hydroxyphenyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-6-yl]cyclopropanecarboxamide
CID 163252146
cis-methyl (1R,2S)-2-[[2-(2-methoxy-4-methylphenyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]carbamoyl]cyclopropane-1-carboxylate
CID 170238276

Frequently Asked Questions

What is the IUPAC name of N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide?
The IUPAC name of N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide (CID 167374759) is N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide is Cc1cc2c(ccn2COCC[Si](C)(C)C)cc1-c1cc2cc(NC(=O)C3CC3)ncc2n1C.
What is the InChIKey of N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide?
The InChIKey is HCQNBSANRATKGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34N4O2Si/c1-18-12-23-20(8-9-31(23)17-33-10-11-34(3,4)5)13-22(18)24-14-21-15-26(28-16-25(21)30(24)2)29-27(32)19-6-7-19/h8-9,12-16,19H,6-7,10-11,17H2,1-5H3,(H,28,29,32).
What are the key properties of N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide?
N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide has a molecular weight of 474.68 g/mol, XLogP of 6.16, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-methyl-2-[6-methyl-1-(2-trimethylsilylethoxymethyl)indol-5-yl]pyrrolo[2,3-c]pyridin-5-yl]cyclopropanecarboxamide is sourced from PubChem (CID 167374759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).