N-methyl-2-(2-methylphenyl)-2-propoxyethanamine

C13H21NO — CID 62106404

IUPACN-methyl-2-(2-methylphenyl)-2-propoxyethanamine
SMILESCCCOC(CNC)c1ccccc1C
InChIInChI=1S/C13H21NO/c1-4-9-15-13(10-14-3)12-8-6-5-7-11(12)2/h5-8,13-14H,4,9-10H2,1-3H3
InChIKeyVLKQDBZAZPWQGU-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.68
Rot. Bonds6

About N-methyl-2-(2-methylphenyl)-2-propoxyethanamine

N-methyl-2-(2-methylphenyl)-2-propoxyethanamine (PubChem CID 62106404) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is N-methyl-2-(2-methylphenyl)-2-propoxyethanamine.

Molecular Properties

Compound NameN-methyl-2-(2-methylphenyl)-2-propoxyethanamine
PubChem CID62106404
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC NameN-methyl-2-(2-methylphenyl)-2-propoxyethanamine
SMILESCCCOC(CNC)c1ccccc1C
InChIInChI=1S/C13H21NO/c1-4-9-15-13(10-14-3)12-8-6-5-7-11(12)2/h5-8,13-14H,4,9-10H2,1-3H3
InChIKeyVLKQDBZAZPWQGU-UHFFFAOYSA-N
XLogP2.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-(2-methylphenyl)-2-(2-propoxyethoxy)ethanamine
CID 63684704
2-(2-fluorophenyl)-N-methyl-2-propoxyethanamine
CID 62108186
2-(3-methoxy-3-methylbutoxy)-N-methyl-2-(2-methylphenyl)ethanamine
CID 106667108
2-[(3-methoxyphenyl)methoxy]-N-methyl-2-(2-methylphenyl)ethanamine
CID 62106288
N-[2-(2-cyclopropylethoxy)-2-(2-methylphenyl)ethyl]propan-1-amine
CID 106204944
N-[2-(2-methoxyethoxy)-2-(2-methylphenyl)ethyl]-2-methylpropan-2-amine
CID 55036431
N-methyl-2-(2-methylphenyl)-2-(oxetan-3-yloxy)ethanamine
CID 102607797
N-ethyl-2-(3-methoxy-3-methylbutoxy)-2-(2-methylphenyl)ethanamine
CID 106667087
4-ethoxy-N-methyl-2-(2-methylphenyl)butan-1-amine
CID 79421089
2-(methylamino)-1-(2-methylphenyl)ethanol
CID 14888492
N-[2-(3-methoxypropoxy)-2-(2-methylphenyl)ethyl]-2-methylpropan-2-amine
CID 62108762
N-[2-(2-methylphenyl)-2-[2-(2-methylpropoxy)ethoxy]ethyl]propan-2-amine
CID 106449233

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylphenyl)-2-propoxyethanamine?
The IUPAC name of N-methyl-2-(2-methylphenyl)-2-propoxyethanamine (CID 62106404) is N-methyl-2-(2-methylphenyl)-2-propoxyethanamine.
What is the SMILES notation for N-methyl-2-(2-methylphenyl)-2-propoxyethanamine?
The canonical SMILES for N-methyl-2-(2-methylphenyl)-2-propoxyethanamine is CCCOC(CNC)c1ccccc1C.
What is the InChIKey of N-methyl-2-(2-methylphenyl)-2-propoxyethanamine?
The InChIKey is VLKQDBZAZPWQGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-4-9-15-13(10-14-3)12-8-6-5-7-11(12)2/h5-8,13-14H,4,9-10H2,1-3H3.
What are the key properties of N-methyl-2-(2-methylphenyl)-2-propoxyethanamine?
N-methyl-2-(2-methylphenyl)-2-propoxyethanamine has a molecular weight of 207.32 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylphenyl)-2-propoxyethanamine is sourced from PubChem (CID 62106404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).