N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine

C19H26N2O3S — CID 19012555

IUPACN,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine
SMILESCN(C)CCc1ccc2cc(CS(=O)(=O)N3CCOCC3)ccc2c1
InChIInChI=1S/C19H26N2O3S/c1-20(2)8-7-16-3-5-19-14-17(4-6-18(19)13-16)15-25(22,23)21-9-11-24-12-10-21/h3-6,13-14H,7-12,15H2,1-2H3
InChIKeyRKVSWHKNRFSLHW-UHFFFAOYSA-N
MW362.50 g/mol
LogP2.11
Rot. Bonds6

About N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine

N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine (PubChem CID 19012555) has the molecular formula C19H26N2O3S and a molecular weight of 362.50 g/mol. Its IUPAC name is N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine
PubChem CID19012555
Molecular FormulaC19H26N2O3S
Molecular Weight362.50 g/mol
Exact Mass362.17
IUPAC NameN,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine
SMILESCN(C)CCc1ccc2cc(CS(=O)(=O)N3CCOCC3)ccc2c1
InChIInChI=1S/C19H26N2O3S/c1-20(2)8-7-16-3-5-19-14-17(4-6-18(19)13-16)15-25(22,23)21-9-11-24-12-10-21/h3-6,13-14H,7-12,15H2,1-2H3
InChIKeyRKVSWHKNRFSLHW-UHFFFAOYSA-N
XLogP2.11
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.50
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(morpholin-4-ylsulfonylmethyl)aniline
CID 43255619
4-(1,4-oxazepan-4-ylsulfonylmethyl)aniline
CID 62987423
2-[1-tert-butyl-5-(pyrrolidin-1-ylsulfonylmethyl)indol-3-yl]-N,N-dimethylethanamine
CID 59825321
3-[2-(dimethylamino)ethyl]-5-(pyrrolidin-1-ylsulfonylmethyl)-1H-indole-2-carboxylic acid
CID 19417475
(4-methylpiperazin-1-yl)-[4-(morpholin-4-ylsulfonylmethyl)phenyl]methanone
CID 46763499
1-[(3,4-dichlorophenyl)methylsulfonyl]-4-ethylsulfonylpiperazine
CID 56581987
N,N-dimethyl-1-[4-(morpholin-4-ylsulfonylmethyl)benzoyl]-2,3-dihydroindole-5-sulfonamide
CID 92646503
N,N-dimethyl-4-[(4-methylphenyl)methylsulfonyl]piperazine-1-sulfonamide
CID 110819072
1-(3-methylphenyl)-N-(2-morpholin-4-ylsulfonylethyl)methanesulfonamide
CID 110287654
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,N-dimethylethanamine
CID 117043729
N-(2,4-dimethoxyphenyl)-4-(morpholin-4-ylsulfonylmethyl)benzamide
CID 99951275
N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 110476324

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine?
The IUPAC name of N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine (CID 19012555) is N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine.
What is the SMILES notation for N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine?
The canonical SMILES for N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine is CN(C)CCc1ccc2cc(CS(=O)(=O)N3CCOCC3)ccc2c1.
What is the InChIKey of N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine?
The InChIKey is RKVSWHKNRFSLHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3S/c1-20(2)8-7-16-3-5-19-14-17(4-6-18(19)13-16)15-25(22,23)21-9-11-24-12-10-21/h3-6,13-14H,7-12,15H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine?
N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine has a molecular weight of 362.50 g/mol, XLogP of 2.11, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[6-(morpholin-4-ylsulfonylmethyl)naphthalen-2-yl]ethanamine is sourced from PubChem (CID 19012555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).