N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide

Name: N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₉H₂₁N₃O₂S — CID 171446127

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACN-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide

SMILESCN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)s1

InChIInChI=1S/C19H21N3O2S/c1-22(2)10-4-9-21-19(24)17-7-6-16(25-17)14-11-13-5-3-8-20-18(13)15(23)12-14/h3,5-8,11-12,23H,4,9-10H2,1-2H3,(H,21,24)

InChIKeyQNWHQAJUKRMJMU-UHFFFAOYSA-N

MW355.46 g/mol

LogP3.35

Rot. Bonds6

About N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide

N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide (PubChem CID 171446127) has the molecular formula C₁₉H₂₁N₃O₂S and a molecular weight of 355.46 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name	N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide
PubChem CID	171446127
Molecular Formula	C₁₉H₂₁N₃O₂S
Molecular Weight	355.46 g/mol
Exact Mass	355.14
IUPAC Name	N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide
SMILES	CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)s1
InChI	InChI=1S/C19H21N3O2S/c1-22(2)10-4-9-21-19(24)17-7-6-16(25-17)14-11-13-5-3-8-20-18(13)15(23)12-14/h3,5-8,11-12,23H,4,9-10H2,1-2H3,(H,21,24)
InChIKey	QNWHQAJUKRMJMU-UHFFFAOYSA-N
XLogP	3.35
TPSA	65.46 Å²
H-Bond Donors	2
H-Bond Acceptors	5
Rotatable Bonds	6
Heavy Atoms	25
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	355.46
LogP ≤ 5	3.35
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

Structural Alerts	{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide?

The IUPAC name of N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide (CID 171446127) is N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide.

What is the SMILES notation for N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide?

The canonical SMILES for N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide is CN(C)CCCNC(=O)c1ccc(-c2cc(O)c3ncccc3c2)s1.

What is the InChIKey of N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide?

The InChIKey is QNWHQAJUKRMJMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2S/c1-22(2)10-4-9-21-19(24)17-7-6-16(25-17)14-11-13-5-3-8-20-18(13)15(23)12-14/h3,5-8,11-12,23H,4,9-10H2,1-2H3,(H,21,24).

What are the key properties of N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide?

N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide has a molecular weight of 355.46 g/mol, XLogP of 3.35, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-(dimethylamino)propyl]-5-(8-hydroxyquinolin-6-yl)thiophene-2-carboxamide is sourced from PubChem (CID 171446127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 171446127 — identifiers, structure, computed properties (public domain)

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