N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine

C15H23NO — CID 103987146

IUPACN-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine
SMILESCCNC(Cc1ccccc1)CC1CCOC1
InChIInChI=1S/C15H23NO/c1-2-16-15(11-14-8-9-17-12-14)10-13-6-4-3-5-7-13/h3-7,14-16H,2,8-12H2,1H3
InChIKeyZDEOXOFKBPHQFL-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.63
Rot. Bonds6

About N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine

N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine (PubChem CID 103987146) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine
PubChem CID103987146
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine
SMILESCCNC(Cc1ccccc1)CC1CCOC1
InChIInChI=1S/C15H23NO/c1-2-16-15(11-14-8-9-17-12-14)10-13-6-4-3-5-7-13/h3-7,14-16H,2,8-12H2,1H3
InChIKeyZDEOXOFKBPHQFL-UHFFFAOYSA-N
XLogP2.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine
CID 103987352
1-cyclohexyl-N-ethyl-3-phenylpropan-2-amine
CID 55188118
N-ethyl-1-(1-methylpyrazol-4-yl)-3-(oxolan-3-yl)propan-2-amine
CID 113362176
1-(3-bromo-4-fluorophenyl)-N-ethyl-3-(oxolan-3-yl)propan-2-amine
CID 103987220
4-[2-(ethylamino)-3-(oxolan-3-yl)propyl]pyridin-2-amine
CID 103987201
1-(4-chlorophenyl)-N-ethyl-3-(oxan-4-yl)propan-2-amine
CID 62601125
1-(4-bromophenyl)-3-(oxolan-3-yl)-N-propylpropan-2-amine
CID 103987520
1-(4-ethylphenyl)-N-methyl-3-(oxolan-3-yl)propan-2-amine
CID 113362150
1-cyclopentyl-N-ethyl-3-(oxolan-3-yl)propan-2-amine
CID 103987304
[1-(oxan-4-yl)-3-phenylpropan-2-yl]hydrazine
CID 105195157
1-(4-chloro-2-fluorophenyl)-N-ethyl-3-(oxolan-3-yl)propan-2-amine
CID 114856904
1-(4-iodophenyl)-N-methyl-3-(oxolan-3-yl)propan-2-amine
CID 103987071

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine?
The IUPAC name of N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine (CID 103987146) is N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine.
What is the SMILES notation for N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine?
The canonical SMILES for N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine is CCNC(Cc1ccccc1)CC1CCOC1.
What is the InChIKey of N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine?
The InChIKey is ZDEOXOFKBPHQFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-16-15(11-14-8-9-17-12-14)10-13-6-4-3-5-7-13/h3-7,14-16H,2,8-12H2,1H3.
What are the key properties of N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine?
N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine has a molecular weight of 233.36 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine is sourced from PubChem (CID 103987146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).