N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine

C9H16N4O2S — CID 115300233

IUPACN-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine
SMILESCNC1CCN(S(=O)(=O)c2cnc(C)[nH]2)C1
InChIInChI=1S/C9H16N4O2S/c1-7-11-5-9(12-7)16(14,15)13-4-3-8(6-13)10-2/h5,8,10H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyDLOZZZNHHAYVBC-UHFFFAOYSA-N
MW244.32 g/mol
LogP-0.30
Rot. Bonds3

About N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine

N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine (PubChem CID 115300233) has the molecular formula C9H16N4O2S and a molecular weight of 244.32 g/mol. Its IUPAC name is N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine
PubChem CID115300233
Molecular FormulaC9H16N4O2S
Molecular Weight244.32 g/mol
Exact Mass244.10
IUPAC NameN-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine
SMILESCNC1CCN(S(=O)(=O)c2cnc(C)[nH]2)C1
InChIInChI=1S/C9H16N4O2S/c1-7-11-5-9(12-7)16(14,15)13-4-3-8(6-13)10-2/h5,8,10H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyDLOZZZNHHAYVBC-UHFFFAOYSA-N
XLogP-0.30
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-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-methyl-1-(1H-pyrazol-4-ylsulfonyl)pyrrolidin-3-amine
CID 115300228
(3R)-N-methyl-1-(3-methylpyrazin-2-yl)sulfonylpiperidin-3-amine
CID 97164762
N-methyl-1-(3-methylpyrazin-2-yl)sulfonylpiperidin-3-amine
CID 71642687
1-[4-[(2-methyl-1H-imidazol-5-yl)sulfonyl]morpholin-2-yl]ethanamine
CID 115315246
N-methyl-1-(1-methylpyrazol-4-yl)sulfonylpyrrolidin-3-amine
CID 115300352
5-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]piperidin-3-amine
CID 79993396
1-(2-bromoethyl)-4-[(2-methyl-1H-imidazol-5-yl)sulfonyl]piperazine
CID 80675816
5-[3-(methylamino)pyrrolidin-1-yl]sulfonylpyridine-2-carbonitrile
CID 115752142
3-[(2-ethyl-1H-imidazol-5-yl)sulfonyl]-9-methyl-3,9-diazabicyclo[4.2.1]nonane
CID 79170789
1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]azepan-2-amine
CID 64560534
1-ethylsulfonyl-N-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-4-amine
CID 62743069
1-(1,2-dimethylimidazol-4-yl)sulfonyl-N-methylpiperidin-3-amine
CID 62536924

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine?
The IUPAC name of N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine (CID 115300233) is N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine.
What is the SMILES notation for N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine?
The canonical SMILES for N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine is CNC1CCN(S(=O)(=O)c2cnc(C)[nH]2)C1.
What is the InChIKey of N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine?
The InChIKey is DLOZZZNHHAYVBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2S/c1-7-11-5-9(12-7)16(14,15)13-4-3-8(6-13)10-2/h5,8,10H,3-4,6H2,1-2H3,(H,11,12).
What are the key properties of N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine?
N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine has a molecular weight of 244.32 g/mol, XLogP of -0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-3-amine is sourced from PubChem (CID 115300233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).