N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine

C14H23NOS — CID 65156624

IUPACN-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine
SMILESCCNC(CC1CCCO1)c1ccc(CC)s1
InChIInChI=1S/C14H23NOS/c1-3-12-7-8-14(17-12)13(15-4-2)10-11-6-5-9-16-11/h7-8,11,13,15H,3-6,9-10H2,1-2H3
InChIKeyVLPQYWUGJWJWEH-UHFFFAOYSA-N
MW253.41 g/mol
LogP3.53
Rot. Bonds6

About N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine

N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine (PubChem CID 65156624) has the molecular formula C14H23NOS and a molecular weight of 253.41 g/mol. Its IUPAC name is N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine
PubChem CID65156624
Molecular FormulaC14H23NOS
Molecular Weight253.41 g/mol
Exact Mass253.15
IUPAC NameN-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine
SMILESCCNC(CC1CCCO1)c1ccc(CC)s1
InChIInChI=1S/C14H23NOS/c1-3-12-7-8-14(17-12)13(15-4-2)10-11-6-5-9-16-11/h7-8,11,13,15H,3-6,9-10H2,1-2H3
InChIKeyVLPQYWUGJWJWEH-UHFFFAOYSA-N
XLogP3.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol
CID 65149785
N-ethyl-1-(5-ethylthiophen-2-yl)-3-(oxolan-2-yl)propan-2-amine
CID 62600752
1-(4,5-dibromothiophen-2-yl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 80533971
1-(5-ethylthiophen-2-yl)-N-[2-(oxolan-2-yl)ethyl]ethanamine
CID 61335920
N-ethyl-1-(5-methylfuran-2-yl)-2-(oxolan-2-yl)ethanamine
CID 65156443
2-(5-ethylthiophen-2-yl)-2-(oxolan-2-ylmethylamino)acetonitrile
CID 55062169
N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine
CID 65156100
[1-(5-methylthiophen-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198565
2-[chloro-(5-ethylthiophen-2-yl)methyl]oxolane
CID 61082899
N-ethyl-1-(5-ethylthiophen-2-yl)ethane-1,2-diamine
CID 62344671
1-(4-tert-butylphenyl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 62550488
1-(3,4-dimethylphenyl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 62550458

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine?
The IUPAC name of N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine (CID 65156624) is N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine is CCNC(CC1CCCO1)c1ccc(CC)s1.
What is the InChIKey of N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine?
The InChIKey is VLPQYWUGJWJWEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NOS/c1-3-12-7-8-14(17-12)13(15-4-2)10-11-6-5-9-16-11/h7-8,11,13,15H,3-6,9-10H2,1-2H3.
What are the key properties of N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine?
N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine has a molecular weight of 253.41 g/mol, XLogP of 3.53, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine is sourced from PubChem (CID 65156624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).