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

C11H19NOS — CID 78964655

IUPAC2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol
SMILESCN(CCc1cccs1)CC(C)(C)O
InChIInChI=1S/C11H19NOS/c1-11(2,13)9-12(3)7-6-10-5-4-8-14-10/h4-5,8,13H,6-7,9H2,1-3H3
InChIKeyNAZLTPWPAMZUFB-UHFFFAOYSA-N
MW213.35 g/mol
LogP1.99
Rot. Bonds5

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

2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol (PubChem CID 78964655) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol
PubChem CID78964655
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC Name2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol
SMILESCN(CCc1cccs1)CC(C)(C)O
InChIInChI=1S/C11H19NOS/c1-11(2,13)9-12(3)7-6-10-5-4-8-14-10/h4-5,8,13H,6-7,9H2,1-3H3
InChIKeyNAZLTPWPAMZUFB-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-2-[[methyl(2-thiophen-2-ylethyl)amino]methyl]butanoic acid
CID 79485922
(2S)-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol
CID 94254566
N,N-dimethyl-2-thiophen-2-ylethanamine;hydrochloride
CID 19760547
2-methyl-1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
CID 79486869
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(thiophen-2-ylmethyl)acetamide
CID 78957766
2-methyl-6-thiophen-2-ylhexan-2-ol
CID 96656971
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(2-thiophen-2-ylethyl)propanamide
CID 111750360
3-[methyl(2-thiophen-2-ylethyl)amino]propanenitrile
CID 63774352
2-bromo-N-methyl-N-(2-thiophen-2-ylethyl)propan-1-amine
CID 80668223
1-chloro-3-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol
CID 112561777
5-[methyl(2-thiophen-2-ylethyl)amino]pentan-2-one
CID 79486633
N'-methyl-N'-(2-thiophen-2-ylethyl)heptane-1,7-diamine
CID 79488346

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol?
The IUPAC name of 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol (CID 78964655) is 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol.
What is the SMILES notation for 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol?
The canonical SMILES for 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol is CN(CCc1cccs1)CC(C)(C)O.
What is the InChIKey of 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol?
The InChIKey is NAZLTPWPAMZUFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-11(2,13)9-12(3)7-6-10-5-4-8-14-10/h4-5,8,13H,6-7,9H2,1-3H3.
What are the key properties of 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol?
2-methyl-1-[methyl(2-thiophen-2-ylethyl)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 2-methyl-1-[methyl(2-thiophen-2-ylethyl)amino]propan-2-ol is sourced from PubChem (CID 78964655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).