3-methoxy-1-thiophen-2-ylpentan-2-amine

C10H17NOS — CID 116715036

IUPAC3-methoxy-1-thiophen-2-ylpentan-2-amine
SMILESCCC(OC)C(N)Cc1cccs1
InChIInChI=1S/C10H17NOS/c1-3-10(12-2)9(11)7-8-5-4-6-13-8/h4-6,9-10H,3,7,11H2,1-2H3
InChIKeyZLDCNKZOKHPLIZ-UHFFFAOYSA-N
MW199.32 g/mol
LogP2.04
Rot. Bonds5

About 3-methoxy-1-thiophen-2-ylpentan-2-amine

3-methoxy-1-thiophen-2-ylpentan-2-amine (PubChem CID 116715036) has the molecular formula C10H17NOS and a molecular weight of 199.32 g/mol. Its IUPAC name is 3-methoxy-1-thiophen-2-ylpentan-2-amine.

Molecular Properties

Compound Name3-methoxy-1-thiophen-2-ylpentan-2-amine
PubChem CID116715036
Molecular FormulaC10H17NOS
Molecular Weight199.32 g/mol
Exact Mass199.10
IUPAC Name3-methoxy-1-thiophen-2-ylpentan-2-amine
SMILESCCC(OC)C(N)Cc1cccs1
InChIInChI=1S/C10H17NOS/c1-3-10(12-2)9(11)7-8-5-4-6-13-8/h4-6,9-10H,3,7,11H2,1-2H3
InChIKeyZLDCNKZOKHPLIZ-UHFFFAOYSA-N
XLogP2.04
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-thiophen-2-ylpentan-2-amine
CID 61079599
1,1-dimethoxy-3-thiophen-2-ylpropan-2-amine
CID 79492317
(3-methoxy-1-thiophen-2-ylpentan-2-yl)hydrazine
CID 105270824
3-methyl-1-thiophen-2-ylhexan-2-amine
CID 61078853
(2S)-1-methoxy-3-thiophen-2-ylpropan-2-amine
CID 94868216
3-methoxy-1-(1,3-thiazol-2-yl)pentan-2-amine
CID 116715056
methyl (2S)-2-amino-3-thiophen-2-ylpropanoate
CID 10899351
2-(2-bromo-3-methylpentyl)thiophene
CID 63017436
3-methoxy-1-thiophen-2-ylbutan-2-ol
CID 79616428
ethane;(2S)-1-methoxy-3-thiophen-2-ylpropan-2-amine;molecular hydrogen
CID 177035877
1-(4-bromophenyl)-3-methoxypentan-2-amine
CID 116715134
2-(2-methoxy-4-methylpentyl)thiophene
CID 56988379

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-thiophen-2-ylpentan-2-amine?
The IUPAC name of 3-methoxy-1-thiophen-2-ylpentan-2-amine (CID 116715036) is 3-methoxy-1-thiophen-2-ylpentan-2-amine.
What is the SMILES notation for 3-methoxy-1-thiophen-2-ylpentan-2-amine?
The canonical SMILES for 3-methoxy-1-thiophen-2-ylpentan-2-amine is CCC(OC)C(N)Cc1cccs1.
What is the InChIKey of 3-methoxy-1-thiophen-2-ylpentan-2-amine?
The InChIKey is ZLDCNKZOKHPLIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOS/c1-3-10(12-2)9(11)7-8-5-4-6-13-8/h4-6,9-10H,3,7,11H2,1-2H3.
What are the key properties of 3-methoxy-1-thiophen-2-ylpentan-2-amine?
3-methoxy-1-thiophen-2-ylpentan-2-amine has a molecular weight of 199.32 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-thiophen-2-ylpentan-2-amine is sourced from PubChem (CID 116715036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).