1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol

C11H19NOS — CID 79485730

IUPAC1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
SMILESCC(O)CN(C)C(C)Cc1cccs1
InChIInChI=1S/C11H19NOS/c1-9(12(3)8-10(2)13)7-11-5-4-6-14-11/h4-6,9-10,13H,7-8H2,1-3H3
InChIKeyFASOBGGGHHQZPU-UHFFFAOYSA-N
MW213.35 g/mol
LogP1.99
Rot. Bonds5

About 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol

1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol (PubChem CID 79485730) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
PubChem CID79485730
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC Name1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
SMILESCC(O)CN(C)C(C)Cc1cccs1
InChIInChI=1S/C11H19NOS/c1-9(12(3)8-10(2)13)7-11-5-4-6-14-11/h4-6,9-10,13H,7-8H2,1-3H3
InChIKeyFASOBGGGHHQZPU-UHFFFAOYSA-N
XLogP1.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
CID 79486869
N'-methyl-N'-(1-thiophen-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79470909
N'-methyl-2-methylidene-N'-(1-thiophen-2-ylpropan-2-yl)propane-1,3-diamine
CID 103070954
3,3,3-trifluoro-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]propanenitrile
CID 103367963
4-bromo-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)butan-1-amine
CID 79486724
4,4-dimethyl-1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]pentan-3-one
CID 79486739
4-[methyl(1-thiophen-2-ylpropan-2-yl)amino]butanethioamide
CID 79476073
1-(diethylamino)-3-thiophen-2-ylpropan-2-ol
CID 121219027
(2S)-1-[propan-2-yl(thiophen-2-ylmethyl)amino]propan-2-ol
CID 106932766
N'-methyl-N'-(1-thiophen-2-ylpropan-2-yl)pentane-1,5-diamine
CID 79476552
[2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]phenyl]boronic acid
CID 79486657
6-[methyl(1-thiophen-2-ylpropan-2-yl)amino]hexan-2-one
CID 79486782

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol?
The IUPAC name of 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol (CID 79485730) is 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol.
What is the SMILES notation for 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol?
The canonical SMILES for 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol is CC(O)CN(C)C(C)Cc1cccs1.
What is the InChIKey of 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol?
The InChIKey is FASOBGGGHHQZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-9(12(3)8-10(2)13)7-11-5-4-6-14-11/h4-6,9-10,13H,7-8H2,1-3H3.
What are the key properties of 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol?
1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol has a molecular weight of 213.35 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol is sourced from PubChem (CID 79485730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).