N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide

C19H30N2O3S — CID 113142895

IUPACN-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide
SMILESCCc1cccc(C)c1N(CCC(=O)NC1CCCCC1)S(C)(=O)=O
InChIInChI=1S/C19H30N2O3S/c1-4-16-10-8-9-15(2)19(16)21(25(3,23)24)14-13-18(22)20-17-11-6-5-7-12-17/h8-10,17H,4-7,11-14H2,1-3H3,(H,20,22)
InChIKeyBJUCPYFCZJUXPA-UHFFFAOYSA-N
MW366.53 g/mol
LogP3.16
Rot. Bonds7

About N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide

N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide (PubChem CID 113142895) has the molecular formula C19H30N2O3S and a molecular weight of 366.53 g/mol. Its IUPAC name is N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide
PubChem CID113142895
Molecular FormulaC19H30N2O3S
Molecular Weight366.53 g/mol
Exact Mass366.20
IUPAC NameN-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide
SMILESCCc1cccc(C)c1N(CCC(=O)NC1CCCCC1)S(C)(=O)=O
InChIInChI=1S/C19H30N2O3S/c1-4-16-10-8-9-15(2)19(16)21(25(3,23)24)14-13-18(22)20-17-11-6-5-7-12-17/h8-10,17H,4-7,11-14H2,1-3H3,(H,20,22)
InChIKeyBJUCPYFCZJUXPA-UHFFFAOYSA-N
XLogP3.16
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.53
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-3-(2-methyl-N-methylsulfonyl-6-propan-2-ylanilino)propanamide
CID 113143249
N-cyclopropyl-2-(2-ethyl-6-methyl-N-methylsulfonylanilino)acetamide
CID 113154205
N-cyclopentyl-3-[N-methylsulfonyl-2,6-di(propan-2-yl)anilino]propanamide
CID 113146226
N-cyclopropyl-3-(2,3-dimethyl-N-methylsulfonylanilino)propanamide
CID 113142557
N-cyclopentyl-3-(3,4-dimethyl-N-methylsulfonylanilino)propanamide
CID 113142233
3-(2-ethyl-6-methyl-N-methylsulfonylanilino)-N-[(2-fluorophenyl)methyl]propanamide
CID 113142916
3-(3-chloro-4-methyl-N-methylsulfonylanilino)-N-cycloheptylpropanamide
CID 113144205
3-(2,6-diethyl-N-methylsulfonylanilino)-N-(2-methylphenyl)propanamide
CID 113143230
N-cyclohexyl-2-(2,3-dimethyl-N-methylsulfonylanilino)acetamide
CID 700395
methyl 3-[[3-(cyclohexylamino)-3-oxopropyl]-methylsulfonylamino]benzoate
CID 113145595
3-(4-bromo-N-methylsulfonylanilino)-N-cyclopentylpropanamide
CID 113144427
N-[2-(2-ethyl-6-methyl-N-methylsulfonylanilino)ethyl]-2-methylpropanamide
CID 113069288

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide?
The IUPAC name of N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide (CID 113142895) is N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide.
What is the SMILES notation for N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide?
The canonical SMILES for N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide is CCc1cccc(C)c1N(CCC(=O)NC1CCCCC1)S(C)(=O)=O.
What is the InChIKey of N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide?
The InChIKey is BJUCPYFCZJUXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O3S/c1-4-16-10-8-9-15(2)19(16)21(25(3,23)24)14-13-18(22)20-17-11-6-5-7-12-17/h8-10,17H,4-7,11-14H2,1-3H3,(H,20,22).
What are the key properties of N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide?
N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide has a molecular weight of 366.53 g/mol, XLogP of 3.16, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(2-ethyl-6-methyl-N-methylsulfonylanilino)propanamide is sourced from PubChem (CID 113142895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).