N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide

C14H20N2O2S — CID 54884366

IUPACN-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
SMILESCN(CC1CC1)S(=O)(=O)c1ccc2c(c1)CCCN2
InChIInChI=1S/C14H20N2O2S/c1-16(10-11-4-5-11)19(17,18)13-6-7-14-12(9-13)3-2-8-15-14/h6-7,9,11,15H,2-5,8,10H2,1H3
InChIKeyZYAXXEBYMZFKQW-UHFFFAOYSA-N
MW280.39 g/mol
LogP2.08
Rot. Bonds4

About N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide

N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide (PubChem CID 54884366) has the molecular formula C14H20N2O2S and a molecular weight of 280.39 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
PubChem CID54884366
Molecular FormulaC14H20N2O2S
Molecular Weight280.39 g/mol
Exact Mass280.12
IUPAC NameN-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
SMILESCN(CC1CC1)S(=O)(=O)c1ccc2c(c1)CCCN2
InChIInChI=1S/C14H20N2O2S/c1-16(10-11-4-5-11)19(17,18)13-6-7-14-12(9-13)3-2-8-15-14/h6-7,9,11,15H,2-5,8,10H2,1H3
InChIKeyZYAXXEBYMZFKQW-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclobutylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 62856404
N-methyl-N-(oxan-3-ylmethyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 63708062
N-methyl-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 79701884
N-(5-hydroxypentyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 107200792
N-(1H-imidazol-2-ylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 64518866
N-methyl-N-phenyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 22692420
N-cyclopentyl-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43267403
6-propylsulfonyl-1,2,3,4-tetrahydroquinoline
CID 82044394
N-methyl-N-(piperidin-3-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 106630837
N-(cyclopentylmethyl)-N-methyl-2,3-dihydro-1H-isoindole-5-sulfonamide
CID 107422155
N-cycloheptyl-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43614367
N-butan-2-yl-N-ethyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 43274848

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide (CID 54884366) is N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide is CN(CC1CC1)S(=O)(=O)c1ccc2c(c1)CCCN2.
What is the InChIKey of N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide?
The InChIKey is ZYAXXEBYMZFKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2S/c1-16(10-11-4-5-11)19(17,18)13-6-7-14-12(9-13)3-2-8-15-14/h6-7,9,11,15H,2-5,8,10H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide?
N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide has a molecular weight of 280.39 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide is sourced from PubChem (CID 54884366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).