N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide

C11H23NO2S — CID 146435825

IUPACN-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide
SMILESCC[C@H](C(C)C)N(CC1CC1)S(C)(=O)=O
InChIInChI=1S/C11H23NO2S/c1-5-11(9(2)3)12(15(4,13)14)8-10-6-7-10/h9-11H,5-8H2,1-4H3/t11-/m1/s1
InChIKeyBOXXYGKCRAIUFK-LLVKDONJSA-N
MW233.38 g/mol
LogP2.09
Rot. Bonds6

About N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide

N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide (PubChem CID 146435825) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide
PubChem CID146435825
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC NameN-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide
SMILESCC[C@H](C(C)C)N(CC1CC1)S(C)(=O)=O
InChIInChI=1S/C11H23NO2S/c1-5-11(9(2)3)12(15(4,13)14)8-10-6-7-10/h9-11H,5-8H2,1-4H3/t11-/m1/s1
InChIKeyBOXXYGKCRAIUFK-LLVKDONJSA-N
XLogP2.09
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-N-[(2R)-5-methylhexan-2-yl]methanesulfonamide
CID 170081112
N-(cyclopropylmethyl)-N-propan-2-ylethanesulfonamide
CID 63738150
N-(oxan-4-ylmethyl)-N-propan-2-ylmethanesulfonamide
CID 21034326
[pent-4-en-2-yl(sulfamoyl)amino]methylcyclopropane
CID 166665809
N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine
CID 79707694
N-(cyclopropylmethyl)-N-propan-2-ylpiperazine-1-sulfonamide
CID 54999539
1-methylsulfonyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylmethanesulfonamide
CID 82842964
4-[cyclopropylmethyl(propan-2-yl)sulfamoyl]benzenesulfonyl fluoride
CID 114791532
4-amino-N-(cyclopropylmethyl)-N-propan-2-ylbenzenesulfonamide
CID 55001042
N-[(4-ethylcyclohexyl)methyl]-N-methylpropan-2-amine
CID 170952528
2-N-(cyclopropylmethyl)-2-N-ethyl-3-methyl-1-N-propan-2-ylbutane-1,2-diamine
CID 63938927
1-amino-N-(cyclopropylmethyl)-N-propan-2-ylcyclopropane-1-carboxamide
CID 65465577

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide (CID 146435825) is N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide is CC[C@H](C(C)C)N(CC1CC1)S(C)(=O)=O.
What is the InChIKey of N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide?
The InChIKey is BOXXYGKCRAIUFK-LLVKDONJSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-5-11(9(2)3)12(15(4,13)14)8-10-6-7-10/h9-11H,5-8H2,1-4H3/t11-/m1/s1.
What are the key properties of N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide?
N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide has a molecular weight of 233.38 g/mol, XLogP of 2.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-[(3R)-2-methylpentan-3-yl]methanesulfonamide is sourced from PubChem (CID 146435825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).