N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide

C18H23N3O4S — CID 46275014

IUPACN-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
SMILESO=C(CCNS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)NC1CCCCC1
InChIInChI=1S/C18H23N3O4S/c22-17-9-6-13-12-15(7-8-16(13)21-17)26(24,25)19-11-10-18(23)20-14-4-2-1-3-5-14/h6-9,12,14,19H,1-5,10-11H2,(H,20,23)(H,21,22)
InChIKeyYYYBBTRCZZCVPP-UHFFFAOYSA-N
MW377.47 g/mol
LogP1.65
Rot. Bonds6

About N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide

N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide (PubChem CID 46275014) has the molecular formula C18H23N3O4S and a molecular weight of 377.47 g/mol. Its IUPAC name is N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
PubChem CID46275014
Molecular FormulaC18H23N3O4S
Molecular Weight377.47 g/mol
Exact Mass377.14
IUPAC NameN-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
SMILESO=C(CCNS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)NC1CCCCC1
InChIInChI=1S/C18H23N3O4S/c22-17-9-6-13-12-15(7-8-16(13)21-17)26(24,25)19-11-10-18(23)20-14-4-2-1-3-5-14/h6-9,12,14,19H,1-5,10-11H2,(H,20,23)(H,21,22)
InChIKeyYYYBBTRCZZCVPP-UHFFFAOYSA-N
XLogP1.65
TPSA108.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylcyclohexyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
CID 46275051
N-cycloheptyl-2-oxo-1H-quinoline-6-sulfonamide
CID 22548526
N-[3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-3-oxopropyl]-2-oxo-1H-quinoline-6-sulfonamide
CID 46275060
3-(benzenesulfonamido)-N-cyclohexylpropanamide
CID 17225810
N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
CID 46275018
3-(naphthalen-2-ylsulfonylamino)-N-piperidin-4-ylpropanamide
CID 119388771
N-cyclohexyl-3-[(3,4-diethoxyphenyl)sulfonylamino]propanamide
CID 55913304
N-(3-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
CID 126459076
N-[3-(azepan-1-yl)propyl]-2-oxo-1H-quinoline-6-sulfonamide
CID 22548591
N-cyclooctyl-1-[(2-oxo-1H-quinolin-6-yl)sulfonyl]piperidine-4-carboxamide
CID 22549884
N-cyclooctyl-3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]propanamide
CID 46258690
[2-(cyclopentylamino)-2-oxoethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate
CID 7414480

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide?
The IUPAC name of N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide (CID 46275014) is N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide.
What is the SMILES notation for N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide?
The canonical SMILES for N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide is O=C(CCNS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide?
The InChIKey is YYYBBTRCZZCVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O4S/c22-17-9-6-13-12-15(7-8-16(13)21-17)26(24,25)19-11-10-18(23)20-14-4-2-1-3-5-14/h6-9,12,14,19H,1-5,10-11H2,(H,20,23)(H,21,22).
What are the key properties of N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide?
N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide has a molecular weight of 377.47 g/mol, XLogP of 1.65, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide is sourced from PubChem (CID 46275014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).