3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide

C18H19N7O — CID 66557172

IUPAC3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide
SMILESCCn1ccnc1-c1c[nH]c2c(C(=O)Nc3ccn(C)n3)nc(C)cc12
InChIInChI=1S/C18H19N7O/c1-4-25-8-6-19-17(25)13-10-20-15-12(13)9-11(2)21-16(15)18(26)22-14-5-7-24(3)23-14/h5-10,20H,4H2,1-3H3,(H,22,23,26)
InChIKeyGDTOGQSLXZZPET-UHFFFAOYSA-N
MW349.40 g/mol
LogP2.74
Rot. Bonds4

About 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide

3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide (PubChem CID 66557172) has the molecular formula C18H19N7O and a molecular weight of 349.40 g/mol. Its IUPAC name is 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide
PubChem CID66557172
Molecular FormulaC18H19N7O
Molecular Weight349.40 g/mol
Exact Mass349.17
IUPAC Name3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide
SMILESCCn1ccnc1-c1c[nH]c2c(C(=O)Nc3ccn(C)n3)nc(C)cc12
InChIInChI=1S/C18H19N7O/c1-4-25-8-6-19-17(25)13-10-20-15-12(13)9-11(2)21-16(15)18(26)22-14-5-7-24(3)23-14/h5-10,20H,4H2,1-3H3,(H,22,23,26)
InChIKeyGDTOGQSLXZZPET-UHFFFAOYSA-N
XLogP2.74
TPSA93.42 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.40
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide?
The IUPAC name of 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide (CID 66557172) is 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide.
What is the SMILES notation for 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide?
The canonical SMILES for 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide is CCn1ccnc1-c1c[nH]c2c(C(=O)Nc3ccn(C)n3)nc(C)cc12.
What is the InChIKey of 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide?
The InChIKey is GDTOGQSLXZZPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7O/c1-4-25-8-6-19-17(25)13-10-20-15-12(13)9-11(2)21-16(15)18(26)22-14-5-7-24(3)23-14/h5-10,20H,4H2,1-3H3,(H,22,23,26).
What are the key properties of 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide?
3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide has a molecular weight of 349.40 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylimidazol-2-yl)-5-methyl-N-(1-methylpyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 66557172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).