2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine

C14H23NOS — CID 79917629

IUPAC2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine
SMILESCC(NC1CC(C)(C)OC1(C)C)c1cccs1
InChIInChI=1S/C14H23NOS/c1-10(11-7-6-8-17-11)15-12-9-13(2,3)16-14(12,4)5/h6-8,10,12,15H,9H2,1-5H3
InChIKeySRVXZTGMHQQXOD-UHFFFAOYSA-N
MW253.41 g/mol
LogP3.74
Rot. Bonds3

About 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine

2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine (PubChem CID 79917629) has the molecular formula C14H23NOS and a molecular weight of 253.41 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine
PubChem CID79917629
Molecular FormulaC14H23NOS
Molecular Weight253.41 g/mol
Exact Mass253.15
IUPAC Name2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine
SMILESCC(NC1CC(C)(C)OC1(C)C)c1cccs1
InChIInChI=1S/C14H23NOS/c1-10(11-7-6-8-17-11)15-12-9-13(2,3)16-14(12,4)5/h6-8,10,12,15H,9H2,1-5H3
InChIKeySRVXZTGMHQQXOD-UHFFFAOYSA-N
XLogP3.74
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-(2-chlorophenyl)ethyl]-2,2,5,5-tetramethyloxolan-3-amine
CID 81377263
(2R)-2-[[(3R)-2,2,5,5-tetramethyloxolan-3-yl]amino]-N-(thiophen-2-ylmethyl)propanamide
CID 99632804
2,2,5,5-tetramethyl-N-(thiophen-2-ylmethyl)oxolan-3-amine
CID 79918908
N-[(1S)-1-(4-chlorophenyl)ethyl]-2,2,5,5-tetramethyloxolan-3-amine
CID 81352114
2,2,5,5-tetramethyl-N-(2-methyl-1-phenylpropyl)oxolan-3-amine
CID 79916834
1,7,7-trimethyl-N-(1-thiophen-2-ylethyl)bicyclo[2.2.1]heptan-2-amine
CID 43223472
2,2-dimethyl-3-(2-methylpropoxy)-N-[(1S)-1-thiophen-2-ylethyl]cyclobutan-1-amine
CID 81398534
3,3-dimethyl-N-[(1R)-1-thiophen-2-ylethyl]cyclohexan-1-amine
CID 81398337
N-[1-(2-methoxy-5-methylphenyl)ethyl]-2,2,5,5-tetramethyloxolan-3-amine
CID 79907759
N-(1-thiophen-2-ylethyl)cyclohexanamine
CID 25219735
N-[2-(2,2,6,6-tetramethylmorpholin-4-yl)ethyl]-1-thiophen-2-ylethanamine
CID 102746104
N-[(1R)-1-thiophen-2-ylethyl]-1,4-dioxaspiro[4.5]decan-8-amine
CID 28683986

Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine?
The IUPAC name of 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine (CID 79917629) is 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine.
What is the SMILES notation for 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine?
The canonical SMILES for 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine is CC(NC1CC(C)(C)OC1(C)C)c1cccs1.
What is the InChIKey of 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine?
The InChIKey is SRVXZTGMHQQXOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NOS/c1-10(11-7-6-8-17-11)15-12-9-13(2,3)16-14(12,4)5/h6-8,10,12,15H,9H2,1-5H3.
What are the key properties of 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine?
2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine has a molecular weight of 253.41 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-N-(1-thiophen-2-ylethyl)oxolan-3-amine is sourced from PubChem (CID 79917629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).