N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide

C10H22N2O2S — CID 79652520

IUPACN-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide
SMILESCN(CC(C)(C)CN)S(=O)(=O)CC1CC1
InChIInChI=1S/C10H22N2O2S/c1-10(2,7-11)8-12(3)15(13,14)6-9-4-5-9/h9H,4-8,11H2,1-3H3
InChIKeyZKCNBFDIGZJLLE-UHFFFAOYSA-N
MW234.36 g/mol
LogP0.64
Rot. Bonds6

About N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide

N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide (PubChem CID 79652520) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide
PubChem CID79652520
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide
SMILESCN(CC(C)(C)CN)S(=O)(=O)CC1CC1
InChIInChI=1S/C10H22N2O2S/c1-10(2,7-11)8-12(3)15(13,14)6-9-4-5-9/h9H,4-8,11H2,1-3H3
InChIKeyZKCNBFDIGZJLLE-UHFFFAOYSA-N
XLogP0.64
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)-3-fluoro-N-methylpropane-1-sulfonamide
CID 119991410
N-(2,2-dimethylpropyl)cyclopropanesulfonamide
CID 57877637
N-methyl-N-(2-methylpropyl)cyclopropanesulfonamide
CID 59833054
N-[3-(dimethylamino)propyl]-3-methylbutane-2-sulfonamide
CID 167001413
N-(3-aminopropyl)-N-methylbutane-1-sulfonamide
CID 28387156
2-amino-N-methyl-N-(2-methylpropyl)ethanesulfonamide
CID 43272093
2-amino-N-ethyl-N-(2-methylpropyl)ethanesulfonamide
CID 43273757
4-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]butane-1-sulfonamide
CID 54952450
N-cyclopropyl-N-(2-methylpropyl)-2-(propan-2-ylamino)ethanesulfonamide
CID 55001410
N-cyclopropyl-N-(2-methylpropyl)-3-(propan-2-ylamino)propane-1-sulfonamide
CID 55001508
N-[3-(dimethylamino)-2,2-dimethylpropyl]propane-1-sulfonamide
CID 60641806
N-[3-(dimethylamino)-2,2-dimethylpropyl]ethanesulfonamide
CID 60642842

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide (CID 79652520) is N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide is CN(CC(C)(C)CN)S(=O)(=O)CC1CC1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide?
The InChIKey is ZKCNBFDIGZJLLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-10(2,7-11)8-12(3)15(13,14)6-9-4-5-9/h9H,4-8,11H2,1-3H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide?
N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide has a molecular weight of 234.36 g/mol, XLogP of 0.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-1-cyclopropyl-N-methylmethanesulfonamide is sourced from PubChem (CID 79652520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).