N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine

C15H32N4O2S — CID 95635483

IUPACN-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine
SMILESC[C@@H](C1CC1)N(C)S(=O)(=O)N(C)CCCN1CCN(C)CC1
InChIInChI=1S/C15H32N4O2S/c1-14(15-6-7-15)18(4)22(20,21)17(3)8-5-9-19-12-10-16(2)11-13-19/h14-15H,5-13H2,1-4H3/t14-/m0/s1
InChIKeyULODHGPHKJPALD-AWEZNQCLSA-N
MW332.51 g/mol
LogP0.53
Rot. Bonds8

About N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine

N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine (PubChem CID 95635483) has the molecular formula C15H32N4O2S and a molecular weight of 332.51 g/mol. Its IUPAC name is N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine.

Molecular Properties

Compound NameN-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine
PubChem CID95635483
Molecular FormulaC15H32N4O2S
Molecular Weight332.51 g/mol
Exact Mass332.22
IUPAC NameN-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine
SMILESC[C@@H](C1CC1)N(C)S(=O)(=O)N(C)CCCN1CCN(C)CC1
InChIInChI=1S/C15H32N4O2S/c1-14(15-6-7-15)18(4)22(20,21)17(3)8-5-9-19-12-10-16(2)11-13-19/h14-15H,5-13H2,1-4H3/t14-/m0/s1
InChIKeyULODHGPHKJPALD-AWEZNQCLSA-N
XLogP0.53
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.51
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-cyclopropylethyl(methyl)sulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine
CID 56806853
N,2-dimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]propane-1-sulfonamide
CID 56806854
N,N-dimethyl-3-(4-methylpiperazin-1-yl)propan-1-amine
CID 13330581
1-methyl-4-[5-(4-propan-2-ylpiperidin-1-yl)pentyl]piperazine
CID 163269266
(8aS)-N-[(1S)-1-cyclopropylethyl]-N-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-sulfonamide
CID 129461274
1-[1-cyclopropylethyl(methyl)sulfamoyl]piperidine-4-carboxylic acid
CID 60857965
N-(1-cyclopropylethyl)-N-methylsulfamoyl chloride
CID 43569022
2-[methyl-[3-(4-methylpiperazin-1-yl)propyl]amino]ethanol
CID 122495081
1-cyclopropyl-N-methyl-N-[methyl-[(4-propan-2-yl-1,2,4-triazol-3-yl)methyl]sulfamoyl]ethanamine
CID 138044224
3-(aziridin-1-yl)-N,N-dimethylpropan-1-amine
CID 154296752
1-methyl-4-[4-(3-propan-2-yloxypropyl)piperazin-1-yl]sulfonylpiperazine
CID 167867117
3-chloro-N-(1-cyclopropylethyl)-N-methylpropane-1-sulfonamide
CID 43653873

Frequently Asked Questions

What is the IUPAC name of N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine?
The IUPAC name of N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine (CID 95635483) is N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine.
What is the SMILES notation for N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine?
The canonical SMILES for N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine is C[C@@H](C1CC1)N(C)S(=O)(=O)N(C)CCCN1CCN(C)CC1.
What is the InChIKey of N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine?
The InChIKey is ULODHGPHKJPALD-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H32N4O2S/c1-14(15-6-7-15)18(4)22(20,21)17(3)8-5-9-19-12-10-16(2)11-13-19/h14-15H,5-13H2,1-4H3/t14-/m0/s1.
What are the key properties of N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine?
N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine has a molecular weight of 332.51 g/mol, XLogP of 0.53, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1S)-1-cyclopropylethyl]-methylsulfamoyl]-N-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine is sourced from PubChem (CID 95635483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).