1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine

C11H17NOS — CID 62601063

IUPAC1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine
SMILESNC(Cc1ccsc1)CC1CCCO1
InChIInChI=1S/C11H17NOS/c12-10(6-9-3-5-14-8-9)7-11-2-1-4-13-11/h3,5,8,10-11H,1-2,4,6-7,12H2
InChIKeyBHFHSFRHGIZIFR-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.19
Rot. Bonds4

About 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine

1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine (PubChem CID 62601063) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine.

Molecular Properties

Compound Name1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine
PubChem CID62601063
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine
SMILESNC(Cc1ccsc1)CC1CCCO1
InChIInChI=1S/C11H17NOS/c12-10(6-9-3-5-14-8-9)7-11-2-1-4-13-11/h3,5,8,10-11H,1-2,4,6-7,12H2
InChIKeyBHFHSFRHGIZIFR-UHFFFAOYSA-N
XLogP2.19
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine
CID 105198709
1-(oxolan-2-yl)-2-thiophen-3-ylethanamine
CID 61080120
N-(oxolan-2-ylmethyl)-1-thiophen-3-ylpropan-2-amine
CID 61474165
1-(4-chlorophenyl)-3-(oxan-2-yl)propan-2-amine
CID 113391539
1-(oxolan-2-yl)-3-pyridin-3-ylpropan-2-amine
CID 62604735
1,3-bis(oxolan-2-yl)propan-2-amine
CID 62601237
1-(oxolan-2-yl)-2-thiophen-3-ylethanol
CID 65330907
1-(oxolan-2-yl)-3-(2,4,6-trimethylphenyl)propan-2-amine
CID 55085081
1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-amine
CID 63774614
1-(4-fluoro-2-methylphenyl)-3-(oxolan-2-yl)propan-2-amine
CID 114347642
1-(2,4-dichlorophenyl)-3-(oxolan-2-yl)propan-2-amine
CID 62600088
1-cyclopropyl-3-(oxolan-2-yl)propan-2-amine
CID 64905481

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine?
The IUPAC name of 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine (CID 62601063) is 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine.
What is the SMILES notation for 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine?
The canonical SMILES for 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine is NC(Cc1ccsc1)CC1CCCO1.
What is the InChIKey of 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine?
The InChIKey is BHFHSFRHGIZIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c12-10(6-9-3-5-14-8-9)7-11-2-1-4-13-11/h3,5,8,10-11H,1-2,4,6-7,12H2.
What are the key properties of 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine?
1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine has a molecular weight of 211.33 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-2-amine is sourced from PubChem (CID 62601063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).