(2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide

C18H28N2O4S — CID 99958114

IUPAC(2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide
SMILESCOc1ccc(N([C@H](C)C(=O)N(C)C2CCCCC2)S(C)(=O)=O)cc1
InChIInChI=1S/C18H28N2O4S/c1-14(18(21)19(2)15-8-6-5-7-9-15)20(25(4,22)23)16-10-12-17(24-3)13-11-16/h10-15H,5-9H2,1-4H3/t14-/m1/s1
InChIKeyMIFZYOUCELFMBU-CQSZACIVSA-N
MW368.50 g/mol
LogP2.64
Rot. Bonds6

About (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide

(2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide (PubChem CID 99958114) has the molecular formula C18H28N2O4S and a molecular weight of 368.50 g/mol. Its IUPAC name is (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide.

Molecular Properties

Compound Name(2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide
PubChem CID99958114
Molecular FormulaC18H28N2O4S
Molecular Weight368.50 g/mol
Exact Mass368.18
IUPAC Name(2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide
SMILESCOc1ccc(N([C@H](C)C(=O)N(C)C2CCCCC2)S(C)(=O)=O)cc1
InChIInChI=1S/C18H28N2O4S/c1-14(18(21)19(2)15-8-6-5-7-9-15)20(25(4,22)23)16-10-12-17(24-3)13-11-16/h10-15H,5-9H2,1-4H3/t14-/m1/s1
InChIKeyMIFZYOUCELFMBU-CQSZACIVSA-N
XLogP2.64
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.50
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-cyclohexyl-N-methyl-2-(N-methylsulfonylanilino)propanamide
CID 94018728
(2R)-N-cyclopentyl-N-methyl-2-(4-methyl-N-methylsulfonylanilino)propanamide
CID 92679401
(2R)-N-cyclohexyl-2-(3,4-dimethyl-N-methylsulfonylanilino)-N-methylpropanamide
CID 28632212
(2R)-N-cycloheptyl-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 1326575
(2S)-N-cyclohexyl-2-[(4-methoxyphenyl)sulfonylamino]-N-methylpropanamide
CID 34247715
2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 2888930
(2R)-N-(2-cyclohexylsulfanylethyl)-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 126031838
N-cyclohexyl-2-(6-methoxynaphthalen-2-yl)-N-methylpropanamide
CID 74853038
(2S)-N-cyclohexyl-N-methyl-2-(4-methyl-N-methylsulfonylanilino)butanamide
CID 99958583
N-(1-hydrazinyl-1-oxopropan-2-yl)-N-(4-methoxyphenyl)methanesulfonamide
CID 91671599
(2S)-N-cyclohexyl-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-methylpropanamide
CID 8746180
(2S)-N,N-dibenzyl-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 1004340

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide?
The IUPAC name of (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide (CID 99958114) is (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide.
What is the SMILES notation for (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide?
The canonical SMILES for (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide is COc1ccc(N([C@H](C)C(=O)N(C)C2CCCCC2)S(C)(=O)=O)cc1.
What is the InChIKey of (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide?
The InChIKey is MIFZYOUCELFMBU-CQSZACIVSA-N. The full InChI is InChI=1S/C18H28N2O4S/c1-14(18(21)19(2)15-8-6-5-7-9-15)20(25(4,22)23)16-10-12-17(24-3)13-11-16/h10-15H,5-9H2,1-4H3/t14-/m1/s1.
What are the key properties of (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide?
(2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide has a molecular weight of 368.50 g/mol, XLogP of 2.64, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclohexyl-2-(4-methoxy-N-methylsulfonylanilino)-N-methylpropanamide is sourced from PubChem (CID 99958114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).