N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine

C11H19NOS — CID 75495456

IUPACN-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine
SMILESCOCC(C)NCC(C)c1cccs1
InChIInChI=1S/C11H19NOS/c1-9(11-5-4-6-14-11)7-12-10(2)8-13-3/h4-6,9-10,12H,7-8H2,1-3H3
InChIKeyCMIZNHIETVTVIO-UHFFFAOYSA-N
MW213.35 g/mol
LogP2.48
Rot. Bonds6

About N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine

N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine (PubChem CID 75495456) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine
PubChem CID75495456
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC NameN-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine
SMILESCOCC(C)NCC(C)c1cccs1
InChIInChI=1S/C11H19NOS/c1-9(11-5-4-6-14-11)7-12-10(2)8-13-3/h4-6,9-10,12H,7-8H2,1-3H3
InChIKeyCMIZNHIETVTVIO-UHFFFAOYSA-N
XLogP2.48
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-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

Ethanethiol, 2-(2-(3-methyl-2-thienyl)propyl)amino-, hydrogen sulfate (ester)
CID 3050988
(2-Methoxyethyl)[(thiophen-2-yl)methyl]amine
CID 4719999
1-(2-Methoxyethyl)-3-(1-(thiophen-2-yl)propan-2-yl)urea
CID 45504424
1-(2-methoxyethyl)-3-[(2S)-1-thiophen-2-ylpropan-2-yl]urea
CID 51895051
2-[(3-Methyl-1-thiophen-2-ylbutyl)amino]propane-1,3-diol
CID 75428432
(2S)-N-(2-methoxyethyl)-N-methyl-1-thiophen-2-ylpropan-2-amine
CID 96569485
N-butyl-1-(disulfanyl)-2-methyl-1-thiophen-2-ylpropan-2-amine
CID 290293
(S,Z)-4-((tert-Butyldimethylsilyl)oxy)-8-methyl-N-(2-(thiophen-2-yl)ethyl)nona-1,4-dien-3-amine
CID 134813845
(S,Z)-4-((tert-butyldimethylsilyl)oxy)-8-methyl-N-(2-(thiophen-2-yl)ethyl)non-4-en-3-amine
CID 134813856
1-thiophen-3-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]propan-2-amine
CID 54962068
1-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]butan-1-amine
CID 54962738
1-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]propan-1-amine
CID 55151711

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine (CID 75495456) is N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine is COCC(C)NCC(C)c1cccs1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine?
The InChIKey is CMIZNHIETVTVIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-9(11-5-4-6-14-11)7-12-10(2)8-13-3/h4-6,9-10,12H,7-8H2,1-3H3.
What are the key properties of N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine?
N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine has a molecular weight of 213.35 g/mol, XLogP of 2.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 75495456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).