N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine

C16H25NO2 — CID 43489770

IUPACN-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine
SMILESCCNC(c1ccc(CCOC)cc1)C1CCCO1
InChIInChI=1S/C16H25NO2/c1-3-17-16(15-5-4-11-19-15)14-8-6-13(7-9-14)10-12-18-2/h6-9,15-17H,3-5,10-12H2,1-2H3
InChIKeyUXTDONGFXCKADH-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.71
Rot. Bonds7

About N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine

N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine (PubChem CID 43489770) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine
PubChem CID43489770
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine
SMILESCCNC(c1ccc(CCOC)cc1)C1CCCO1
InChIInChI=1S/C16H25NO2/c1-3-17-16(15-5-4-11-19-15)14-8-6-13(7-9-14)10-12-18-2/h6-9,15-17H,3-5,10-12H2,1-2H3
InChIKeyUXTDONGFXCKADH-UHFFFAOYSA-N
XLogP2.71
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[4-(2-methoxyethyl)phenyl]-(5-methyloxolan-2-yl)methyl]ethanamine
CID 81330130
N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine
CID 43489767
2-[bromo-[4-(2-methoxyethyl)phenyl]methyl]oxolane
CID 61097079
N-[oxolan-2-yl-(4-propoxyphenyl)methyl]ethanamine
CID 65328700
N-[[4-(2-methoxyethyl)phenyl]-(oxan-3-yl)methyl]propan-1-amine
CID 63012897
N-[(3,5-difluorophenyl)-(oxolan-2-yl)methyl]ethanamine
CID 65328304
N-[cyclopentyl-[4-(2-methoxyethyl)phenyl]methyl]propan-1-amine
CID 43495393
N-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxan-2-yl)methyl]ethanamine
CID 62215137
N-[(4-bromophenyl)-(oxolan-2-yl)methyl]propan-1-amine
CID 43494552
N-[(4-ethoxyphenyl)-(oxolan-2-yl)methyl]propan-1-amine
CID 43495188
1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine
CID 43482389
N-[(3-bromo-4-propoxyphenyl)-(oxan-2-yl)methyl]ethanamine
CID 104658037

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine?
The IUPAC name of N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine (CID 43489770) is N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine?
The canonical SMILES for N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine is CCNC(c1ccc(CCOC)cc1)C1CCCO1.
What is the InChIKey of N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine?
The InChIKey is UXTDONGFXCKADH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-3-17-16(15-5-4-11-19-15)14-8-6-13(7-9-14)10-12-18-2/h6-9,15-17H,3-5,10-12H2,1-2H3.
What are the key properties of N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine?
N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine has a molecular weight of 263.38 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-methoxyethyl)phenyl]-(oxolan-2-yl)methyl]ethanamine is sourced from PubChem (CID 43489770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).