N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine

C14H18N2O2S — CID 47319808

IUPACN-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine
SMILESCN(C)S(=O)(=O)N(C)Cc1cccc2ccccc12
InChIInChI=1S/C14H18N2O2S/c1-15(2)19(17,18)16(3)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10H,11H2,1-3H3
InChIKeyYHNGOTACICSXPW-UHFFFAOYSA-N
MW278.38 g/mol
LogP2.08
Rot. Bonds4

About N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine

N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine (PubChem CID 47319808) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine.

Molecular Properties

Compound NameN-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine
PubChem CID47319808
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC NameN-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine
SMILESCN(C)S(=O)(=O)N(C)Cc1cccc2ccccc12
InChIInChI=1S/C14H18N2O2S/c1-15(2)19(17,18)16(3)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10H,11H2,1-3H3
InChIKeyYHNGOTACICSXPW-UHFFFAOYSA-N
XLogP2.08
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(isoquinolin-5-ylmethyl)-N-methylmethanesulfonamide
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N-methyl-N-(naphthalen-1-ylmethyl)carbamoyl bromide
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1-naphthalen-1-yl-N,N-bis(trimethylsilyl)methanamine
CID 11779651
6-cyano-N-methyl-N-(naphthalen-1-ylmethyl)pyridine-3-sulfonamide
CID 166403283
4-N-methyl-4-N-(naphthalen-1-ylmethyl)benzene-1,4-diamine
CID 28894653
2-[naphthalen-1-ylmethyl(2-sulfoethyl)amino]ethanesulfonic acid
CID 102280055
2-[[methyl(naphthalen-1-ylmethyl)amino]methyl]aniline
CID 43458604
N-methyl-N-(2-naphthalen-1-ylethyl)propan-2-amine
CID 117044251
azane;1-ethylnaphthalene
CID 19048185
2-methyl-4-[methyl(naphthalen-1-ylmethyl)amino]butan-2-ol
CID 75423705

Frequently Asked Questions

What is the IUPAC name of N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The IUPAC name of N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine (CID 47319808) is N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine.
What is the SMILES notation for N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The canonical SMILES for N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine is CN(C)S(=O)(=O)N(C)Cc1cccc2ccccc12.
What is the InChIKey of N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The InChIKey is YHNGOTACICSXPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-15(2)19(17,18)16(3)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10H,11H2,1-3H3.
What are the key properties of N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine?
N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine has a molecular weight of 278.38 g/mol, XLogP of 2.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylsulfamoyl)-N-methyl-1-naphthalen-1-ylmethanamine is sourced from PubChem (CID 47319808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).