5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide

C19H19N5O3 — CID 126648438

IUPAC5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2nccc3[nH]ccc23)c1=O
InChIInChI=1S/C19H19N5O3/c1-20-18(26)14-8-11(17(25)23-12-2-3-12)9-24(19(14)27)10-16-13-4-6-21-15(13)5-7-22-16/h4-9,12,21H,2-3,10H2,1H3,(H,20,26)(H,23,25)
InChIKeyHNNDLCHTVLYWGT-UHFFFAOYSA-N
MW365.39 g/mol
LogP1.02
Rot. Bonds5

About 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide

5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide (PubChem CID 126648438) has the molecular formula C19H19N5O3 and a molecular weight of 365.39 g/mol. Its IUPAC name is 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide
PubChem CID126648438
Molecular FormulaC19H19N5O3
Molecular Weight365.39 g/mol
Exact Mass365.15
IUPAC Name5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2nccc3[nH]ccc23)c1=O
InChIInChI=1S/C19H19N5O3/c1-20-18(26)14-8-11(17(25)23-12-2-3-12)9-24(19(14)27)10-16-13-4-6-21-15(13)5-7-22-16/h4-9,12,21H,2-3,10H2,1H3,(H,20,26)(H,23,25)
InChIKeyHNNDLCHTVLYWGT-UHFFFAOYSA-N
XLogP1.02
TPSA108.88 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide (CID 126648438) is 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide is CNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2nccc3[nH]ccc23)c1=O.
What is the InChIKey of 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide?
The InChIKey is HNNDLCHTVLYWGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O3/c1-20-18(26)14-8-11(17(25)23-12-2-3-12)9-24(19(14)27)10-16-13-4-6-21-15(13)5-7-22-16/h4-9,12,21H,2-3,10H2,1H3,(H,20,26)(H,23,25).
What are the key properties of 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide?
5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide has a molecular weight of 365.39 g/mol, XLogP of 1.02, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclopropyl-3-N-methyl-2-oxo-1-(1H-pyrrolo[3,2-c]pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 126648438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).