(1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine

C11H19NS — CID 99621448

IUPAC(1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine
SMILESCCC(CC)C[C@@H](N)c1ccsc1
InChIInChI=1S/C11H19NS/c1-3-9(4-2)7-11(12)10-5-6-13-8-10/h5-6,8-9,11H,3-4,7,12H2,1-2H3/t11-/m1/s1
InChIKeyQWMRJMVEXVWRKW-LLVKDONJSA-N
MW197.35 g/mol
LogP3.57
Rot. Bonds5

About (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine

(1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine (PubChem CID 99621448) has the molecular formula C11H19NS and a molecular weight of 197.35 g/mol. Its IUPAC name is (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine.

Molecular Properties

Compound Name(1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine
PubChem CID99621448
Molecular FormulaC11H19NS
Molecular Weight197.35 g/mol
Exact Mass197.12
IUPAC Name(1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine
SMILESCCC(CC)C[C@@H](N)c1ccsc1
InChIInChI=1S/C11H19NS/c1-3-9(4-2)7-11(12)10-5-6-13-8-10/h5-6,8-9,11H,3-4,7,12H2,1-2H3/t11-/m1/s1
InChIKeyQWMRJMVEXVWRKW-LLVKDONJSA-N
XLogP3.57
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.35
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-3-ethyl-1-thiophen-3-ylpentan-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

(1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride
CID 171210593
(1S)-3,3-difluoro-1-thiophen-3-ylpropan-1-amine;hydrochloride
CID 171313205
1-thiophen-3-ylhexan-1-amine;hydrochloride
CID 86262846
(1S,2R)-1-amino-1-thiophen-3-ylbutan-2-ol
CID 130683153
3-methylidene-1-thiophen-3-ylpentan-1-amine
CID 66044101
(3R)-3-amino-3-thiophen-3-ylpropan-1-ol
CID 1487793
ethyl (3S)-3-amino-3-thiophen-3-ylpropanoate
CID 29059787
3-amino-3-thiophen-3-ylpropanenitrile
CID 55293748
(1S)-3,3,3-trifluoro-1-thiophen-3-ylpropan-1-amine
CID 55296383
2-(3,5-dimethylphenyl)-1-thiophen-3-ylethanamine
CID 61028896
2-cyclopropyl-1-thiophen-3-ylethanamine
CID 55293747
4,4,4-trifluoro-1-thiophen-3-ylbutan-1-amine
CID 64567617

Frequently Asked Questions

What is the IUPAC name of (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine?
The IUPAC name of (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine (CID 99621448) is (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine.
What is the SMILES notation for (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine?
The canonical SMILES for (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine is CCC(CC)C[C@@H](N)c1ccsc1.
What is the InChIKey of (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine?
The InChIKey is QWMRJMVEXVWRKW-LLVKDONJSA-N. The full InChI is InChI=1S/C11H19NS/c1-3-9(4-2)7-11(12)10-5-6-13-8-10/h5-6,8-9,11H,3-4,7,12H2,1-2H3/t11-/m1/s1.
What are the key properties of (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine?
(1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine has a molecular weight of 197.35 g/mol, XLogP of 3.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine is sourced from PubChem (CID 99621448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).