N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide

C14H30N2O2S — CID 62008647

IUPACN-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide
SMILESCCN(C(C)(CC)CN)S(=O)(=O)CC1CCCCC1
InChIInChI=1S/C14H30N2O2S/c1-4-14(3,12-15)16(5-2)19(17,18)11-13-9-7-6-8-10-13/h13H,4-12,15H2,1-3H3
InChIKeyRJTUQNKFALLEAK-UHFFFAOYSA-N
MW290.47 g/mol
LogP2.35
Rot. Bonds7

About N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide

N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide (PubChem CID 62008647) has the molecular formula C14H30N2O2S and a molecular weight of 290.47 g/mol. Its IUPAC name is N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide
PubChem CID62008647
Molecular FormulaC14H30N2O2S
Molecular Weight290.47 g/mol
Exact Mass290.20
IUPAC NameN-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide
SMILESCCN(C(C)(CC)CN)S(=O)(=O)CC1CCCCC1
InChIInChI=1S/C14H30N2O2S/c1-4-14(3,12-15)16(5-2)19(17,18)11-13-9-7-6-8-10-13/h13H,4-12,15H2,1-3H3
InChIKeyRJTUQNKFALLEAK-UHFFFAOYSA-N
XLogP2.35
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.47
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-propylmethanesulfonamide
CID 62008250
2-[cyclohexylmethylsulfonyl(ethyl)amino]-2-methylpropanoic acid
CID 62818726
N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-1-sulfonamide
CID 62009447
1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide
CID 79387330
N-(1-amino-2-methylbutan-2-yl)-N-ethyl-3-methoxypropane-1-sulfonamide
CID 55172878
2-N-(cyclopentylmethyl)-2-N,2-dimethylbutane-1,2-diamine
CID 62009371
N-butyl-N-(2-chloroethyl)-1-cyclohexylmethanesulfonamide
CID 63396856
1-cyclohexyl-N-(2-hydroxyethyl)-N-propan-2-ylmethanesulfonamide
CID 54947469
N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide
CID 79652520
methyl 2-[cyclohexylmethylsulfonyl(ethyl)amino]acetate
CID 54998272
cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
CID 159227929
N-(1-amino-2-methylpropan-2-yl)-N-ethylcyclopropanesulfonamide
CID 64552380

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide?
The IUPAC name of N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide (CID 62008647) is N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide.
What is the SMILES notation for N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide?
The canonical SMILES for N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide is CCN(C(C)(CC)CN)S(=O)(=O)CC1CCCCC1.
What is the InChIKey of N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide?
The InChIKey is RJTUQNKFALLEAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2S/c1-4-14(3,12-15)16(5-2)19(17,18)11-13-9-7-6-8-10-13/h13H,4-12,15H2,1-3H3.
What are the key properties of N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide?
N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide has a molecular weight of 290.47 g/mol, XLogP of 2.35, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylbutan-2-yl)-1-cyclohexyl-N-ethylmethanesulfonamide is sourced from PubChem (CID 62008647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).