2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine

C14H21NO — CID 62106439

IUPAC2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine
SMILESCNCC(OCC1CC1)c1cccc(C)c1
InChIInChI=1S/C14H21NO/c1-11-4-3-5-13(8-11)14(9-15-2)16-10-12-6-7-12/h3-5,8,12,14-15H,6-7,9-10H2,1-2H3
InChIKeyQKYFSVGUXAGSNF-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.68
Rot. Bonds6

About 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine

2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine (PubChem CID 62106439) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine
PubChem CID62106439
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine
SMILESCNCC(OCC1CC1)c1cccc(C)c1
InChIInChI=1S/C14H21NO/c1-11-4-3-5-13(8-11)14(9-15-2)16-10-12-6-7-12/h3-5,8,12,14-15H,6-7,9-10H2,1-2H3
InChIKeyQKYFSVGUXAGSNF-UHFFFAOYSA-N
XLogP2.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-(3-methylphenyl)-2-(oxolan-3-ylmethoxy)ethanamine
CID 62111410
2-(3-chlorophenyl)-2-(cyclopropylmethoxy)-N-methylethanamine
CID 62107327
N-[2-(3-methylphenyl)-2-(oxan-4-ylmethoxy)ethyl]propan-2-amine
CID 62383877
1-[2-bromo-1-(cyclohexylmethoxy)ethyl]-3-methylbenzene
CID 55193250
2-(3,4-dimethylcyclohexyl)oxy-N-methyl-2-(3-methylphenyl)ethanamine
CID 64745158
N-methyl-2-(3-methylphenyl)-2-[2-(2-methylpropoxy)ethoxy]ethanamine
CID 106449148
N-[2-(3-bromophenyl)-2-(cyclopropylmethoxy)ethyl]cyclopropanamine
CID 62108746
N-[3-(cyclopropylmethoxy)-2-(3-methylphenyl)propyl]cyclopropanamine
CID 106930859
N-[2-(cyclopropylmethoxy)-2-(3-methoxyphenyl)ethyl]propan-2-amine
CID 62106084
2-(cyclopentylmethoxy)-2-(4-fluorophenyl)-N-methylethanamine
CID 66323116
N-[2-(2,2-difluoroethoxy)-2-(3-methylphenyl)ethyl]cyclopropanamine
CID 82006736
N-[2-(3-chlorophenyl)-2-(cyclopropylmethoxy)ethyl]propan-1-amine
CID 55036275

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine?
The IUPAC name of 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine (CID 62106439) is 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine?
The canonical SMILES for 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine is CNCC(OCC1CC1)c1cccc(C)c1.
What is the InChIKey of 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine?
The InChIKey is QKYFSVGUXAGSNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11-4-3-5-13(8-11)14(9-15-2)16-10-12-6-7-12/h3-5,8,12,14-15H,6-7,9-10H2,1-2H3.
What are the key properties of 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine?
2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine has a molecular weight of 219.33 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 2-(cyclopropylmethoxy)-N-methyl-2-(3-methylphenyl)ethanamine is sourced from PubChem (CID 62106439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).