4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide

C15H19N5O2 — CID 67278030

IUPAC4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
SMILESCC(=O)N1CCC(Nc2c(C(N)=O)cnc3[nH]ccc23)CC1
InChIInChI=1S/C15H19N5O2/c1-9(21)20-6-3-10(4-7-20)19-13-11-2-5-17-15(11)18-8-12(13)14(16)22/h2,5,8,10H,3-4,6-7H2,1H3,(H2,16,22)(H2,17,18,19)
InChIKeyOZUKOXXARSWVSM-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.08
Rot. Bonds3

About 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide

4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide (PubChem CID 67278030) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
PubChem CID67278030
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Name4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
SMILESCC(=O)N1CCC(Nc2c(C(N)=O)cnc3[nH]ccc23)CC1
InChIInChI=1S/C15H19N5O2/c1-9(21)20-6-3-10(4-7-20)19-13-11-2-5-17-15(11)18-8-12(13)14(16)22/h2,5,8,10H,3-4,6-7H2,1H3,(H2,16,22)(H2,17,18,19)
InChIKeyOZUKOXXARSWVSM-UHFFFAOYSA-N
XLogP1.08
TPSA104.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide?
The IUPAC name of 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide (CID 67278030) is 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide.
What is the SMILES notation for 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide?
The canonical SMILES for 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide is CC(=O)N1CCC(Nc2c(C(N)=O)cnc3[nH]ccc23)CC1.
What is the InChIKey of 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide?
The InChIKey is OZUKOXXARSWVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-9(21)20-6-3-10(4-7-20)19-13-11-2-5-17-15(11)18-8-12(13)14(16)22/h2,5,8,10H,3-4,6-7H2,1H3,(H2,16,22)(H2,17,18,19).
What are the key properties of 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide?
4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.08, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-acetylpiperidin-4-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide is sourced from PubChem (CID 67278030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).