2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine

C13H21NOS — CID 115751420

IUPAC2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine
SMILESCC(CNC1CCOC1C)Cc1cccs1
InChIInChI=1S/C13H21NOS/c1-10(8-12-4-3-7-16-12)9-14-13-5-6-15-11(13)2/h3-4,7,10-11,13-14H,5-6,8-9H2,1-2H3
InChIKeyASUINYQDPWEQMS-UHFFFAOYSA-N
MW239.38 g/mol
LogP2.69
Rot. Bonds5

About 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine

2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine (PubChem CID 115751420) has the molecular formula C13H21NOS and a molecular weight of 239.38 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine
PubChem CID115751420
Molecular FormulaC13H21NOS
Molecular Weight239.38 g/mol
Exact Mass239.13
IUPAC Name2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine
SMILESCC(CNC1CCOC1C)Cc1cccs1
InChIInChI=1S/C13H21NOS/c1-10(8-12-4-3-7-16-12)9-14-13-5-6-15-11(13)2/h3-4,7,10-11,13-14H,5-6,8-9H2,1-2H3
InChIKeyASUINYQDPWEQMS-UHFFFAOYSA-N
XLogP2.69
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.38
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)cyclopentan-1-amine
CID 115689591
(2S,3R)-2-methyl-N-(2-thiophen-2-ylethyl)oxolan-3-amine
CID 97358153
(2S,3R)-2-methyl-N-(2-methylpropyl)oxolan-3-amine
CID 97358057
2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)oxolan-3-amine
CID 115338696
N-[(2R)-2-methyl-3-thiophen-2-ylpropyl]oxane-4-sulfonamide
CID 97217900
1-[(2-methyloxolan-3-yl)amino]-2-thiophen-2-ylpropan-2-ol
CID 115751394
1-[(2-methyloxolan-3-yl)amino]propan-2-ol
CID 75525152
(2R)-1-[[(2R,3R)-2-methyloxolan-3-yl]amino]propan-2-ol
CID 97358024
2-[(2-methyloxolan-3-yl)amino]-1-phenylethanol
CID 115335546
2,2-dimethyl-N-(2-methyl-3-thiophen-2-ylpropyl)propan-1-amine
CID 115655098
2-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]oxolan-3-amine
CID 82726555
N-(1-thiophen-2-ylpropan-2-yl)cyclopropanamine
CID 82262604

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine?
The IUPAC name of 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine (CID 115751420) is 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine.
What is the SMILES notation for 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine?
The canonical SMILES for 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine is CC(CNC1CCOC1C)Cc1cccs1.
What is the InChIKey of 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine?
The InChIKey is ASUINYQDPWEQMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NOS/c1-10(8-12-4-3-7-16-12)9-14-13-5-6-15-11(13)2/h3-4,7,10-11,13-14H,5-6,8-9H2,1-2H3.
What are the key properties of 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine?
2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine has a molecular weight of 239.38 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)oxolan-3-amine is sourced from PubChem (CID 115751420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).