N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide

C15H18N2O3S — CID 115684021

IUPACN,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide
SMILESCN(C)C(=O)CN(C)S(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C15H18N2O3S/c1-16(2)15(18)11-17(3)21(19,20)14-10-6-8-12-7-4-5-9-13(12)14/h4-10H,11H2,1-3H3
InChIKeyKRRMVDULYUDNIN-UHFFFAOYSA-N
MW306.39 g/mol
LogP1.55
Rot. Bonds4

About N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide

N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide (PubChem CID 115684021) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide
PubChem CID115684021
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC NameN,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide
SMILESCN(C)C(=O)CN(C)S(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C15H18N2O3S/c1-16(2)15(18)11-17(3)21(19,20)14-10-6-8-12-7-4-5-9-13(12)14/h4-10H,11H2,1-3H3
InChIKeyKRRMVDULYUDNIN-UHFFFAOYSA-N
XLogP1.55
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl 2-[methyl(naphthalen-1-ylsulfonyl)amino]acetate
CID 3787664
N-(2-hydroxypropyl)-N-methylnaphthalene-1-sulfonamide
CID 115902788
4-[methyl(naphthalen-1-ylsulfonyl)amino]butanoic acid
CID 115776536
methyl 2-[[2-(dimethylamino)-2-oxoethyl]-methylsulfamoyl]benzoate
CID 51169901
N-(2-aminoethyl)-N-methylnaphthalene-1-sulfonamide;hydrochloride
CID 174226998
N-methyl-N-propan-2-ylnaphthalene-1-sulfonamide
CID 21131549
N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide
CID 115752504
N-(1,3-dioxolan-2-ylmethyl)-N-methylnaphthalene-1-sulfonamide
CID 4994619
2-[(2-amino-3-pyridinyl)sulfonyl-methylamino]-N,N-dimethylacetamide
CID 65427602
2-[(4-fluoronaphthalen-1-yl)sulfonyl-methylamino]acetic acid
CID 847773
2-[methyl(naphthalen-1-ylsulfonyl)amino]butanoic acid
CID 114533581
2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]acetamide
CID 115684041

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide?
The IUPAC name of N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide (CID 115684021) is N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide?
The canonical SMILES for N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide is CN(C)C(=O)CN(C)S(=O)(=O)c1cccc2ccccc12.
What is the InChIKey of N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide?
The InChIKey is KRRMVDULYUDNIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-16(2)15(18)11-17(3)21(19,20)14-10-6-8-12-7-4-5-9-13(12)14/h4-10H,11H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide?
N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide has a molecular weight of 306.39 g/mol, XLogP of 1.55, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide is sourced from PubChem (CID 115684021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).