1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine

C10H17NOS — CID 79574491

IUPAC1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine
SMILESCC(C)OCC(N)Cc1cccs1
InChIInChI=1S/C10H17NOS/c1-8(2)12-7-9(11)6-10-4-3-5-13-10/h3-5,8-9H,6-7,11H2,1-2H3
InChIKeyDYVPWPCXEWBLKW-UHFFFAOYSA-N
MW199.32 g/mol
LogP2.04
Rot. Bonds5

About 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine

1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine (PubChem CID 79574491) has the molecular formula C10H17NOS and a molecular weight of 199.32 g/mol. Its IUPAC name is 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine
PubChem CID79574491
Molecular FormulaC10H17NOS
Molecular Weight199.32 g/mol
Exact Mass199.10
IUPAC Name1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine
SMILESCC(C)OCC(N)Cc1cccs1
InChIInChI=1S/C10H17NOS/c1-8(2)12-7-9(11)6-10-4-3-5-13-10/h3-5,8-9H,6-7,11H2,1-2H3
InChIKeyDYVPWPCXEWBLKW-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

Analyze 1-propan-2-yloxy-3-thiophen-2-ylpropan-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

(2S)-1-methoxy-3-thiophen-2-ylpropan-2-amine
CID 94868216
ethane;(2S)-1-methoxy-3-thiophen-2-ylpropan-2-amine;molecular hydrogen
CID 177035877
1-(4-methoxyphenoxy)-3-thiophen-2-ylpropan-2-amine
CID 117246169
N-ethyl-1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine
CID 79574610
3-methyl-1-thiophen-2-ylpentan-2-amine
CID 61079599
1-(5-chlorothiophen-2-yl)-3-propan-2-yloxypropan-2-amine
CID 105135075
4-methyl-5-thiophen-2-ylpentan-2-amine
CID 64721186
1-thiophen-2-yltridecan-2-amine
CID 65428259
5,5-dimethyl-1-thiophen-2-ylhexan-2-amine
CID 62604909
methyl (2S)-2-amino-3-thiophen-2-ylpropanoate
CID 10899351
methyl (3R)-3-amino-4-thiophen-2-ylbutanoate
CID 141263920
3-(2-amino-3-thiophen-2-ylpropoxy)phenol
CID 117246145

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine?
The IUPAC name of 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine (CID 79574491) is 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine.
What is the SMILES notation for 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine?
The canonical SMILES for 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine is CC(C)OCC(N)Cc1cccs1.
What is the InChIKey of 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine?
The InChIKey is DYVPWPCXEWBLKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOS/c1-8(2)12-7-9(11)6-10-4-3-5-13-10/h3-5,8-9H,6-7,11H2,1-2H3.
What are the key properties of 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine?
1-propan-2-yloxy-3-thiophen-2-ylpropan-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 1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine is sourced from PubChem (CID 79574491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).