N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine

C18H25N3O3S — CID 133405257

IUPACN-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine
SMILESCCCc1cc(NCCS(=O)(=O)N2CCOCC2)c2ccccc2n1
InChIInChI=1S/C18H25N3O3S/c1-2-5-15-14-18(16-6-3-4-7-17(16)20-15)19-8-13-25(22,23)21-9-11-24-12-10-21/h3-4,6-7,14H,2,5,8-13H2,1H3,(H,19,20)
InChIKeyBMHNCXIQGIRQGZ-UHFFFAOYSA-N
MW363.48 g/mol
LogP2.26
Rot. Bonds7

About N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine

N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine (PubChem CID 133405257) has the molecular formula C18H25N3O3S and a molecular weight of 363.48 g/mol. Its IUPAC name is N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine
PubChem CID133405257
Molecular FormulaC18H25N3O3S
Molecular Weight363.48 g/mol
Exact Mass363.16
IUPAC NameN-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine
SMILESCCCc1cc(NCCS(=O)(=O)N2CCOCC2)c2ccccc2n1
InChIInChI=1S/C18H25N3O3S/c1-2-5-15-14-18(16-6-3-4-7-17(16)20-15)19-8-13-25(22,23)21-9-11-24-12-10-21/h3-4,6-7,14H,2,5,8-13H2,1H3,(H,19,20)
InChIKeyBMHNCXIQGIRQGZ-UHFFFAOYSA-N
XLogP2.26
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.48
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(2-propylquinolin-4-yl)amino]propanoic acid
CID 122048260
2-(4-methoxyphenyl)-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine
CID 171356984
N-[(3-methyl-4-methylsulfonylphenyl)methyl]-2-propylquinolin-4-amine
CID 133412585
N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide
CID 133405225
N-(2-morpholin-4-ylsulfonylethyl)-7-(trifluoromethyl)quinolin-4-amine
CID 133405255
2-methyl-N-(2-methylsulfonylethyl)quinolin-4-amine
CID 54934838
4-(2-methylsulfonylethylamino)quinoline-2-carboxylic acid
CID 63374041
N-(5-fluoro-2-pyridinyl)-N'-(2-propylquinolin-4-yl)ethane-1,2-diamine
CID 167935119
4-(3-phenylpropylsulfonyl)morpholine
CID 560201
N-(cyclopropylmethyl)-2-[(2-propylquinolin-4-yl)amino]acetamide
CID 133441654
2-[(2-methylquinolin-4-yl)amino]ethanesulfonamide
CID 43552334
1-cyclopropyl-4-[(2-propylquinolin-4-yl)amino]pyrrolidin-2-one
CID 133402841

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine?
The IUPAC name of N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine (CID 133405257) is N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine.
What is the SMILES notation for N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine?
The canonical SMILES for N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine is CCCc1cc(NCCS(=O)(=O)N2CCOCC2)c2ccccc2n1.
What is the InChIKey of N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine?
The InChIKey is BMHNCXIQGIRQGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3S/c1-2-5-15-14-18(16-6-3-4-7-17(16)20-15)19-8-13-25(22,23)21-9-11-24-12-10-21/h3-4,6-7,14H,2,5,8-13H2,1H3,(H,19,20).
What are the key properties of N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine?
N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine has a molecular weight of 363.48 g/mol, XLogP of 2.26, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylsulfonylethyl)-2-propylquinolin-4-amine is sourced from PubChem (CID 133405257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).