2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide

C14H17N3O2S — CID 106057891

IUPAC2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide
SMILESO=S(=O)(CCNC1CC1)Nc1cccc2ncccc12
InChIInChI=1S/C14H17N3O2S/c18-20(19,10-9-15-11-6-7-11)17-14-5-1-4-13-12(14)3-2-8-16-13/h1-5,8,11,15,17H,6-7,9-10H2
InChIKeyXSTSDXFTGOUWJC-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.73
Rot. Bonds6

About 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide

2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide (PubChem CID 106057891) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide
PubChem CID106057891
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide
SMILESO=S(=O)(CCNC1CC1)Nc1cccc2ncccc12
InChIInChI=1S/C14H17N3O2S/c18-20(19,10-9-15-11-6-7-11)17-14-5-1-4-13-12(14)3-2-8-16-13/h1-5,8,11,15,17H,6-7,9-10H2
InChIKeyXSTSDXFTGOUWJC-UHFFFAOYSA-N
XLogP1.73
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

5-Aminoquinoline
CID 11911
8-(Methylsulfonylamino)quinoline
CID 151506
4-Aminoquinoline
CID 68476
7-Aminoquinoline
CID 11377
1-(Phenylsulfonyl)-4-(1-piperazinyl)-1h-indole
CID 10154392
Diethyl[4-(4-quinolylamino)pentyl]amine
CID 474865
Quinoline, 4-(2-diethylamino)ethylamino-
CID 10562205
4-(2-Aminoethyl)aminoquinoline
CID 10821443
N-cyclohexylquinolin-4-amine
CID 44591867
N-[(1S)-1-phenylethyl]quinolin-4-amine
CID 10977813
Fluoroquine
CID 95480
Iodoquine
CID 3571163

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide?
The IUPAC name of 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide (CID 106057891) is 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide?
The canonical SMILES for 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide is O=S(=O)(CCNC1CC1)Nc1cccc2ncccc12.
What is the InChIKey of 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide?
The InChIKey is XSTSDXFTGOUWJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c18-20(19,10-9-15-11-6-7-11)17-14-5-1-4-13-12(14)3-2-8-16-13/h1-5,8,11,15,17H,6-7,9-10H2.
What are the key properties of 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide?
2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide has a molecular weight of 291.38 g/mol, XLogP of 1.73, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-quinolin-5-ylethanesulfonamide is sourced from PubChem (CID 106057891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).