2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine

C15H23NO — CID 103986875

IUPAC2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine
SMILESCCCc1ccc(C(N)CC2CCOC2)cc1
InChIInChI=1S/C15H23NO/c1-2-3-12-4-6-14(7-5-12)15(16)10-13-8-9-17-11-13/h4-7,13,15H,2-3,8-11,16H2,1H3
InChIKeySRKAJVFPEHTCCG-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.07
Rot. Bonds5

About 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine

2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine (PubChem CID 103986875) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine.

Molecular Properties

Compound Name2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine
PubChem CID103986875
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine
SMILESCCCc1ccc(C(N)CC2CCOC2)cc1
InChIInChI=1S/C15H23NO/c1-2-3-12-4-6-14(7-5-12)15(16)10-13-8-9-17-11-13/h4-7,13,15H,2-3,8-11,16H2,1H3
InChIKeySRKAJVFPEHTCCG-UHFFFAOYSA-N
XLogP3.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(oxolan-3-yl)-1-(4-propylphenyl)ethyl]hydrazine
CID 105265959
N-(oxolan-3-ylmethyl)-1-(4-propylphenyl)ethanamine
CID 54931937
2-(oxolan-3-yl)-1-(4-phenylphenyl)ethanamine
CID 103986749
2-(oxolan-3-yl)-1-(1-propylpyrazol-4-yl)ethanamine
CID 103986856
2-(3-methylmorpholin-4-yl)-1-(4-propylphenyl)ethanamine
CID 43542037
1-(3-ethoxyphenyl)-2-(oxolan-3-yl)ethanamine
CID 103986722
3-cyclopentyl-1-(4-propylphenyl)propan-1-amine
CID 43106075
N-[1-(4-ethylphenyl)-2-(oxolan-3-yl)ethyl]propan-1-amine
CID 103987410
(1S)-2-cyclopropyl-1-(4-ethylphenyl)ethanamine;hydrochloride
CID 171230824
2-morpholin-4-yl-1-(4-propylphenyl)ethanamine
CID 16792951
N-[2-(oxolan-3-yl)-1-(3-propylphenyl)ethyl]propan-1-amine
CID 116545062
N-methyl-2-(oxan-4-ylmethoxy)-1-(4-propylphenyl)ethanamine
CID 62382237

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine?
The IUPAC name of 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine (CID 103986875) is 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine.
What is the SMILES notation for 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine?
The canonical SMILES for 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine is CCCc1ccc(C(N)CC2CCOC2)cc1.
What is the InChIKey of 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine?
The InChIKey is SRKAJVFPEHTCCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-3-12-4-6-14(7-5-12)15(16)10-13-8-9-17-11-13/h4-7,13,15H,2-3,8-11,16H2,1H3.
What are the key properties of 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine?
2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine has a molecular weight of 233.35 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-yl)-1-(4-propylphenyl)ethanamine is sourced from PubChem (CID 103986875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).