N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine

C10H15NOS — CID 81398144

IUPACN-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine
SMILESC[C@H](NC1CCOC1)c1cccs1
InChIInChI=1S/C10H15NOS/c1-8(10-3-2-6-13-10)11-9-4-5-12-7-9/h2-3,6,8-9,11H,4-5,7H2,1H3/t8-,9?/m0/s1
InChIKeyYNOWCBLFFPRVSF-IENPIDJESA-N
MW197.30 g/mol
LogP2.19
Rot. Bonds3

About N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine

N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine (PubChem CID 81398144) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine.

Molecular Properties

Compound NameN-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine
PubChem CID81398144
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC NameN-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine
SMILESC[C@H](NC1CCOC1)c1cccs1
InChIInChI=1S/C10H15NOS/c1-8(10-3-2-6-13-10)11-9-4-5-12-7-9/h2-3,6,8-9,11H,4-5,7H2,1H3/t8-,9?/m0/s1
InChIKeyYNOWCBLFFPRVSF-IENPIDJESA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine?
The IUPAC name of N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine (CID 81398144) is N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine.
What is the SMILES notation for N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine?
The canonical SMILES for N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine is C[C@H](NC1CCOC1)c1cccs1.
What is the InChIKey of N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine?
The InChIKey is YNOWCBLFFPRVSF-IENPIDJESA-N. The full InChI is InChI=1S/C10H15NOS/c1-8(10-3-2-6-13-10)11-9-4-5-12-7-9/h2-3,6,8-9,11H,4-5,7H2,1H3/t8-,9?/m0/s1.
What are the key properties of N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine?
N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine has a molecular weight of 197.30 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine is sourced from PubChem (CID 81398144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).