3-thiophen-3-ylpentan-3-amine

C9H15NS — CID 65099925

IUPAC3-thiophen-3-ylpentan-3-amine
SMILESCCC(N)(CC)c1ccsc1
InChIInChI=1S/C9H15NS/c1-3-9(10,4-2)8-5-6-11-7-8/h5-7H,3-4,10H2,1-2H3
InChIKeyOAMPJDYGMZCNRH-UHFFFAOYSA-N
MW169.29 g/mol
LogP2.72
Rot. Bonds3

About 3-thiophen-3-ylpentan-3-amine

3-thiophen-3-ylpentan-3-amine (PubChem CID 65099925) has the molecular formula C9H15NS and a molecular weight of 169.29 g/mol. Its IUPAC name is 3-thiophen-3-ylpentan-3-amine.

Molecular Properties

Compound Name3-thiophen-3-ylpentan-3-amine
PubChem CID65099925
Molecular FormulaC9H15NS
Molecular Weight169.29 g/mol
Exact Mass169.09
IUPAC Name3-thiophen-3-ylpentan-3-amine
SMILESCCC(N)(CC)c1ccsc1
InChIInChI=1S/C9H15NS/c1-3-9(10,4-2)8-5-6-11-7-8/h5-7H,3-4,10H2,1-2H3
InChIKeyOAMPJDYGMZCNRH-UHFFFAOYSA-N
XLogP2.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.29
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-thiophen-3-ylpentan-3-ol
CID 65099780
1-phenyl-1-thiophen-3-ylpropan-1-amine
CID 65100038
2-methyl-2-thiophen-3-ylbutan-1-amine
CID 82412624
2,3-dimethyl-3-thiophen-3-ylbutan-2-amine
CID 18719736
4-(3-aminopentan-3-yl)phenol
CID 23621887
3-thiophen-3-ylpent-1-en-3-ol
CID 130929664
2-methyl-3-thiophen-3-ylpent-1-en-3-ol
CID 131021089
3-(4-tert-butylphenyl)pentan-3-amine
CID 60986945
(2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine
CID 131081620
3-(5-methylnonan-5-yl)thiophene
CID 142069558
(4S)-4-methyl-4-thiophen-3-ylhexan-2-one
CID 137378766
4-amino-3,3-dimethyl-2-thiophen-3-ylbutan-2-ol
CID 127003873

Frequently Asked Questions

What is the IUPAC name of 3-thiophen-3-ylpentan-3-amine?
The IUPAC name of 3-thiophen-3-ylpentan-3-amine (CID 65099925) is 3-thiophen-3-ylpentan-3-amine.
What is the SMILES notation for 3-thiophen-3-ylpentan-3-amine?
The canonical SMILES for 3-thiophen-3-ylpentan-3-amine is CCC(N)(CC)c1ccsc1.
What is the InChIKey of 3-thiophen-3-ylpentan-3-amine?
The InChIKey is OAMPJDYGMZCNRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NS/c1-3-9(10,4-2)8-5-6-11-7-8/h5-7H,3-4,10H2,1-2H3.
What are the key properties of 3-thiophen-3-ylpentan-3-amine?
3-thiophen-3-ylpentan-3-amine has a molecular weight of 169.29 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-thiophen-3-ylpentan-3-amine is sourced from PubChem (CID 65099925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).