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

C20H26N2O3S — CID 9427774

IUPACN-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
SMILESC[C@@H]1CCCC[C@H]1NC(=O)CN(C)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C20H26N2O3S/c1-15-7-3-6-10-19(15)21-20(23)14-22(2)26(24,25)18-12-11-16-8-4-5-9-17(16)13-18/h4-5,8-9,11-13,15,19H,3,6-7,10,14H2,1-2H3,(H,21,23)/t15-,19-/m1/s1
InChIKeyUPTHNWXFBCURIS-DNVCBOLYSA-N
MW374.51 g/mol
LogP3.16
Rot. Bonds5

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

N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide (PubChem CID 9427774) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
PubChem CID9427774
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
SMILESC[C@@H]1CCCC[C@H]1NC(=O)CN(C)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C20H26N2O3S/c1-15-7-3-6-10-19(15)21-20(23)14-22(2)26(24,25)18-12-11-16-8-4-5-9-17(16)13-18/h4-5,8-9,11-13,15,19H,3,6-7,10,14H2,1-2H3,(H,21,23)/t15-,19-/m1/s1
InChIKeyUPTHNWXFBCURIS-DNVCBOLYSA-N
XLogP3.16
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 1292427
1-cyclopentyl-3-[[2-[methyl(naphthalen-2-ylsulfonyl)amino]acetyl]amino]thiourea
CID 9428881
N-[(1S,2S)-2-methylcyclohexyl]-2-naphthalen-2-yloxyacetamide
CID 2517702
2-[(2,5-dichlorophenyl)sulfonyl-methylamino]-N-[(1S,2R)-2-methylcyclohexyl]acetamide
CID 7918992
N-ethyl-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 27276320
2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-naphthalen-2-ylacetamide
CID 9403525
2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 977503
[2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl] 2-[(4-fluorophenyl)sulfonyl-methylamino]acetate
CID 7848709
N-(2,6-diethylphenyl)-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 2203258
N-(2-methoxyethyl)-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 2207014
N-(3,5-dichlorophenyl)-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 45375147
2-[benzenesulfonyl(methyl)amino]-N-cyclooctylacetamide
CID 2988556

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The IUPAC name of N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide (CID 9427774) is N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide.
What is the SMILES notation for N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The canonical SMILES for N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide is C[C@@H]1CCCC[C@H]1NC(=O)CN(C)S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The InChIKey is UPTHNWXFBCURIS-DNVCBOLYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-15-7-3-6-10-19(15)21-20(23)14-22(2)26(24,25)18-12-11-16-8-4-5-9-17(16)13-18/h4-5,8-9,11-13,15,19H,3,6-7,10,14H2,1-2H3,(H,21,23)/t15-,19-/m1/s1.
What are the key properties of N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide?
N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide has a molecular weight of 374.51 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide is sourced from PubChem (CID 9427774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).