1-cyclopentylsulfinyl-N-ethylbutan-2-amine

C11H23NOS — CID 64654211

IUPAC1-cyclopentylsulfinyl-N-ethylbutan-2-amine
SMILESCCNC(CC)CS(=O)C1CCCC1
InChIInChI=1S/C11H23NOS/c1-3-10(12-4-2)9-14(13)11-7-5-6-8-11/h10-12H,3-9H2,1-2H3
InChIKeyQEOLWQIHXSWOMD-UHFFFAOYSA-N
MW217.38 g/mol
LogP2.07
Rot. Bonds6

About 1-cyclopentylsulfinyl-N-ethylbutan-2-amine

1-cyclopentylsulfinyl-N-ethylbutan-2-amine (PubChem CID 64654211) has the molecular formula C11H23NOS and a molecular weight of 217.38 g/mol. Its IUPAC name is 1-cyclopentylsulfinyl-N-ethylbutan-2-amine.

Molecular Properties

Compound Name1-cyclopentylsulfinyl-N-ethylbutan-2-amine
PubChem CID64654211
Molecular FormulaC11H23NOS
Molecular Weight217.38 g/mol
Exact Mass217.15
IUPAC Name1-cyclopentylsulfinyl-N-ethylbutan-2-amine
SMILESCCNC(CC)CS(=O)C1CCCC1
InChIInChI=1S/C11H23NOS/c1-3-10(12-4-2)9-14(13)11-7-5-6-8-11/h10-12H,3-9H2,1-2H3
InChIKeyQEOLWQIHXSWOMD-UHFFFAOYSA-N
XLogP2.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.38
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopentylsulfinyl-N-ethylbutan-2-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-ethyl-1-(2-methyloxolan-3-yl)sulfinylbutan-2-amine
CID 107758395
1-cyclopentylsulfinylpropan-2-amine
CID 64655238
1-cycloheptylsulfinylpropan-2-amine
CID 82934442
1-cyclohexylsulfinyl-N-propylpropan-2-amine
CID 64654364
1-cyclopentylsulfinyl-3-(ethylamino)propan-2-ol
CID 115477120
1-cyclopentylsulfinyl-3-(propan-2-ylamino)propan-2-ol
CID 115477122
N-ethyl-1-(oxan-4-ylsulfinyl)propan-2-amine
CID 64655048
1-cyclopentylsulfinyl-N,3,3-trimethylbutan-2-amine
CID 64656247
1-cyclopentylsulfanyl-N-ethylbutan-2-amine
CID 64628616
1-butylsulfinyl-N-ethylbutan-2-amine
CID 64651265
methyl 3-cycloheptylsulfinyl-2-methylpropanoate
CID 82930890
1,3-dicyclopentyl-N-ethylpropan-2-amine
CID 115847226

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylsulfinyl-N-ethylbutan-2-amine?
The IUPAC name of 1-cyclopentylsulfinyl-N-ethylbutan-2-amine (CID 64654211) is 1-cyclopentylsulfinyl-N-ethylbutan-2-amine.
What is the SMILES notation for 1-cyclopentylsulfinyl-N-ethylbutan-2-amine?
The canonical SMILES for 1-cyclopentylsulfinyl-N-ethylbutan-2-amine is CCNC(CC)CS(=O)C1CCCC1.
What is the InChIKey of 1-cyclopentylsulfinyl-N-ethylbutan-2-amine?
The InChIKey is QEOLWQIHXSWOMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NOS/c1-3-10(12-4-2)9-14(13)11-7-5-6-8-11/h10-12H,3-9H2,1-2H3.
What are the key properties of 1-cyclopentylsulfinyl-N-ethylbutan-2-amine?
1-cyclopentylsulfinyl-N-ethylbutan-2-amine has a molecular weight of 217.38 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylsulfinyl-N-ethylbutan-2-amine is sourced from PubChem (CID 64654211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).