N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide

C15H20N4O — CID 120602247

IUPACN-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide
SMILESCC1CC(NC(=O)Cc2c[nH]c3ncccc23)CCN1
InChIInChI=1S/C15H20N4O/c1-10-7-12(4-6-16-10)19-14(20)8-11-9-18-15-13(11)3-2-5-17-15/h2-3,5,9-10,12,16H,4,6-8H2,1H3,(H,17,18)(H,19,20)
InChIKeyLCGGEJVWSGWYSX-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.36
Rot. Bonds3

About N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide

N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide (PubChem CID 120602247) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide
PubChem CID120602247
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide
SMILESCC1CC(NC(=O)Cc2c[nH]c3ncccc23)CCN1
InChIInChI=1S/C15H20N4O/c1-10-7-12(4-6-16-10)19-14(20)8-11-9-18-15-13(11)3-2-5-17-15/h2-3,5,9-10,12,16H,4,6-8H2,1H3,(H,17,18)(H,19,20)
InChIKeyLCGGEJVWSGWYSX-UHFFFAOYSA-N
XLogP1.36
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide?
The IUPAC name of N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide (CID 120602247) is N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide.
What is the SMILES notation for N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide?
The canonical SMILES for N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide is CC1CC(NC(=O)Cc2c[nH]c3ncccc23)CCN1.
What is the InChIKey of N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide?
The InChIKey is LCGGEJVWSGWYSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-10-7-12(4-6-16-10)19-14(20)8-11-9-18-15-13(11)3-2-5-17-15/h2-3,5,9-10,12,16H,4,6-8H2,1H3,(H,17,18)(H,19,20).
What are the key properties of N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide?
N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide has a molecular weight of 272.35 g/mol, XLogP of 1.36, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-4-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide is sourced from PubChem (CID 120602247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).