N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide

C16H20N4O2 — CID 166222428

IUPACN-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide
SMILESCC(C)(NC(=O)c1ccc2cc[nH]c2n1)C(=O)N1CCCC1
InChIInChI=1S/C16H20N4O2/c1-16(2,15(22)20-9-3-4-10-20)19-14(21)12-6-5-11-7-8-17-13(11)18-12/h5-8H,3-4,9-10H2,1-2H3,(H,17,18)(H,19,21)
InChIKeyGVVURRFJNCZWII-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.69
Rot. Bonds3

About N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide

N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide (PubChem CID 166222428) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide
PubChem CID166222428
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC NameN-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide
SMILESCC(C)(NC(=O)c1ccc2cc[nH]c2n1)C(=O)N1CCCC1
InChIInChI=1S/C16H20N4O2/c1-16(2,15(22)20-9-3-4-10-20)19-14(21)12-6-5-11-7-8-17-13(11)18-12/h5-8H,3-4,9-10H2,1-2H3,(H,17,18)(H,19,21)
InChIKeyGVVURRFJNCZWII-UHFFFAOYSA-N
XLogP1.69
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide with MolForge

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Related Compounds

N-(2-methyl-1-oxo-1-piperidin-1-ylpropan-2-yl)benzamide
CID 90688649
1-(1H-pyrrolo[2,3-b]pyridin-6-yl)ethanone
CID 71743048
cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone
CID 69009468
(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone
CID 127778414
1H-pyrrolo[2,3-b]pyridin-6-yl(1,2,4,5-tetrahydro-3-benzazepin-3-yl)methanone
CID 157016726
2-methyl-1-(1H-pyrrolo[2,3-b]pyridin-6-yl)propan-1-one
CID 71743078
N-[2-methyl-2-(oxan-4-yl)propyl]-1H-pyrrolo[2,3-b]pyridine-6-carboxamide
CID 136566826
(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone
CID 127777972
N-methyl-2-[1-(1H-pyrrolo[2,3-b]pyridine-6-carbonyl)piperidin-4-yl]acetamide
CID 127776962
[4-(4-methylphenoxy)piperidin-1-yl]-(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone
CID 127778121
(2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)-(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone
CID 163305444
2-chloro-N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)acetamide
CID 146109017

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide?
The IUPAC name of N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide (CID 166222428) is N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide.
What is the SMILES notation for N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide?
The canonical SMILES for N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide is CC(C)(NC(=O)c1ccc2cc[nH]c2n1)C(=O)N1CCCC1.
What is the InChIKey of N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide?
The InChIKey is GVVURRFJNCZWII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-16(2,15(22)20-9-3-4-10-20)19-14(21)12-6-5-11-7-8-17-13(11)18-12/h5-8H,3-4,9-10H2,1-2H3,(H,17,18)(H,19,21).
What are the key properties of N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide?
N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-6-carboxamide is sourced from PubChem (CID 166222428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).