N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine

C14H22N2O — CID 65486084

IUPACN-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine
SMILESCOc1ccccc1CC(C)N(C)C1CNC1
InChIInChI=1S/C14H22N2O/c1-11(16(2)13-9-15-10-13)8-12-6-4-5-7-14(12)17-3/h4-7,11,13,15H,8-10H2,1-3H3
InChIKeyULSNKTKFPOWPDM-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.53
Rot. Bonds5

About N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine

N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine (PubChem CID 65486084) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine
PubChem CID65486084
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine
SMILESCOc1ccccc1CC(C)N(C)C1CNC1
InChIInChI=1S/C14H22N2O/c1-11(16(2)13-9-15-10-13)8-12-6-4-5-7-14(12)17-3/h4-7,11,13,15H,8-10H2,1-3H3
InChIKeyULSNKTKFPOWPDM-UHFFFAOYSA-N
XLogP1.53
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide
CID 65488021
trans-(1S,2S)-2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]cyclohexan-1-ol
CID 102732198
N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide
CID 66188008
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpiperazine-2-carboxamide
CID 65486341
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpiperidine-3-carboxamide
CID 65487251
N-[1-(2-fluoro-6-methoxyphenyl)ethyl]-N-methylazetidin-3-amine
CID 113389278
3-ethyl-1-[1-(2-methoxyphenyl)propan-2-yl]-1-methylurea
CID 71994436
[(2R)-1-(2-methoxyphenyl)propan-2-yl]azanium
CID 7432380
3-N-[1-(2-methoxyphenyl)propan-2-yl]-3-N,4-N-dimethyloxane-3,4-diamine
CID 65488358
2-N-ethyl-4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N-methylpentane-2,4-diamine
CID 65487789
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide;hydrochloride
CID 119319100
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopropanecarboximidamide
CID 65486598

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine?
The IUPAC name of N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine (CID 65486084) is N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine.
What is the SMILES notation for N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine?
The canonical SMILES for N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine is COc1ccccc1CC(C)N(C)C1CNC1.
What is the InChIKey of N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine?
The InChIKey is ULSNKTKFPOWPDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11(16(2)13-9-15-10-13)8-12-6-4-5-7-14(12)17-3/h4-7,11,13,15H,8-10H2,1-3H3.
What are the key properties of N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine?
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine has a molecular weight of 234.34 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine is sourced from PubChem (CID 65486084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).