N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine

C14H27NO3S — CID 64676033

IUPACN-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine
SMILESCCNC1CCOCC1S(=O)(=O)C1CCCC(C)C1
InChIInChI=1S/C14H27NO3S/c1-3-15-13-7-8-18-10-14(13)19(16,17)12-6-4-5-11(2)9-12/h11-15H,3-10H2,1-2H3
InChIKeyMIZWFDDYGHMTEV-UHFFFAOYSA-N
MW289.44 g/mol
LogP1.75
Rot. Bonds4

About N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine

N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine (PubChem CID 64676033) has the molecular formula C14H27NO3S and a molecular weight of 289.44 g/mol. Its IUPAC name is N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine.

Molecular Properties

Compound NameN-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine
PubChem CID64676033
Molecular FormulaC14H27NO3S
Molecular Weight289.44 g/mol
Exact Mass289.17
IUPAC NameN-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine
SMILESCCNC1CCOCC1S(=O)(=O)C1CCCC(C)C1
InChIInChI=1S/C14H27NO3S/c1-3-15-13-7-8-18-10-14(13)19(16,17)12-6-4-5-11(2)9-12/h11-15H,3-10H2,1-2H3
InChIKeyMIZWFDDYGHMTEV-UHFFFAOYSA-N
XLogP1.75
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.44
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-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-3-(3-methylcyclohexyl)sulfonyloxan-4-amine
CID 64676036
N-ethyl-4-methyl-2-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64675834
N-ethyl-3,5-dimethyl-2-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64751898
N-ethyl-3-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64717552
N-ethyl-3-(4-fluorophenyl)sulfonyloxan-4-amine
CID 64639620
2-cyclohexylsulfonyl-N,4-diethylcyclohexan-1-amine
CID 64674406
N-methyl-3-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64717554
3-(2-bromophenyl)sulfonyl-N-ethyloxan-4-amine
CID 64644847
4-methyl-2-(3-methylcyclohexyl)sulfonylcyclohexan-1-amine
CID 64676428
3-(3-methylcyclohexyl)sulfonyl-N-propylcyclohexan-1-amine
CID 64717553
2-cyclopentylsulfonyl-N-ethyl-4-propan-2-ylcyclohexan-1-amine
CID 64674704
3-(2-methyloxolan-3-yl)sulfonyl-N-propylcyclohexan-1-amine
CID 107758035

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine?
The IUPAC name of N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine (CID 64676033) is N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine.
What is the SMILES notation for N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine?
The canonical SMILES for N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine is CCNC1CCOCC1S(=O)(=O)C1CCCC(C)C1.
What is the InChIKey of N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine?
The InChIKey is MIZWFDDYGHMTEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO3S/c1-3-15-13-7-8-18-10-14(13)19(16,17)12-6-4-5-11(2)9-12/h11-15H,3-10H2,1-2H3.
What are the key properties of N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine?
N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine has a molecular weight of 289.44 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-methylcyclohexyl)sulfonyloxan-4-amine is sourced from PubChem (CID 64676033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).