(2-propylsulfonylcyclohexyl)methanamine

C10H21NO2S — CID 64698833

IUPAC(2-propylsulfonylcyclohexyl)methanamine
SMILESCCCS(=O)(=O)C1CCCCC1CN
InChIInChI=1S/C10H21NO2S/c1-2-7-14(12,13)10-6-4-3-5-9(10)8-11/h9-10H,2-8,11H2,1H3
InChIKeyLMJGMGIRUNCCGU-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.33
Rot. Bonds4

About (2-propylsulfonylcyclohexyl)methanamine

(2-propylsulfonylcyclohexyl)methanamine (PubChem CID 64698833) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is (2-propylsulfonylcyclohexyl)methanamine.

Molecular Properties

Compound Name(2-propylsulfonylcyclohexyl)methanamine
PubChem CID64698833
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC Name(2-propylsulfonylcyclohexyl)methanamine
SMILESCCCS(=O)(=O)C1CCCCC1CN
InChIInChI=1S/C10H21NO2S/c1-2-7-14(12,13)10-6-4-3-5-9(10)8-11/h9-10H,2-8,11H2,1H3
InChIKeyLMJGMGIRUNCCGU-UHFFFAOYSA-N
XLogP1.33
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-propylsulfonylcyclohexyl)methanamine 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

(2-pentylsulfonylcyclohexyl)methanamine
CID 107766733
2-propylsulfonylcyclohexan-1-amine
CID 64645702
2-propylsulfonylcyclopentan-1-amine
CID 64646493
[2-(2-methylpropylsulfonyl)cycloheptyl]methanamine
CID 64697595
(4-tert-butyl-2-propylsulfonylcyclohexyl)methanamine
CID 64698832
ethyl 2-[2-(aminomethyl)cyclohexyl]sulfonylacetate
CID 64696599
[2-(2-methylbutylsulfonyl)cyclopentyl]methanamine
CID 107767198
(2-butylsulfonyl-4-methylcyclohexyl)methanamine
CID 64697630
N-methyl-2-propylsulfonylcyclooctan-1-amine
CID 64644517
2-propylsulfonylcyclohexane-1-carbonitrile
CID 64689764
N-propyl-2-propylsulfonylcyclooctan-1-amine
CID 64644715
[4-ethyl-2-(2-methylsulfonylethylsulfonyl)cyclohexyl]methanamine
CID 64698812

Frequently Asked Questions

What is the IUPAC name of (2-propylsulfonylcyclohexyl)methanamine?
The IUPAC name of (2-propylsulfonylcyclohexyl)methanamine (CID 64698833) is (2-propylsulfonylcyclohexyl)methanamine.
What is the SMILES notation for (2-propylsulfonylcyclohexyl)methanamine?
The canonical SMILES for (2-propylsulfonylcyclohexyl)methanamine is CCCS(=O)(=O)C1CCCCC1CN.
What is the InChIKey of (2-propylsulfonylcyclohexyl)methanamine?
The InChIKey is LMJGMGIRUNCCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-2-7-14(12,13)10-6-4-3-5-9(10)8-11/h9-10H,2-8,11H2,1H3.
What are the key properties of (2-propylsulfonylcyclohexyl)methanamine?
(2-propylsulfonylcyclohexyl)methanamine has a molecular weight of 219.35 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propylsulfonylcyclohexyl)methanamine is sourced from PubChem (CID 64698833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).