N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine

C15H23NO — CID 113361834

IUPACN-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine
SMILESCOCC(CNC1CC1)Cc1cccc(C)c1
InChIInChI=1S/C15H23NO/c1-12-4-3-5-13(8-12)9-14(11-17-2)10-16-15-6-7-15/h3-5,8,14-16H,6-7,9-11H2,1-2H3
InChIKeyOOJRBYLMWZWDHE-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.55
Rot. Bonds7

About N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine

N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine (PubChem CID 113361834) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine
PubChem CID113361834
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine
SMILESCOCC(CNC1CC1)Cc1cccc(C)c1
InChIInChI=1S/C15H23NO/c1-12-4-3-5-13(8-12)9-14(11-17-2)10-16-15-6-7-15/h3-5,8,14-16H,6-7,9-11H2,1-2H3
InChIKeyOOJRBYLMWZWDHE-UHFFFAOYSA-N
XLogP2.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine 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-[2-benzyl-3-(3-methylphenyl)propyl]cyclopropanamine
CID 62531282
2-(methoxymethyl)-3-(3-methylphenyl)-N-propylpropan-1-amine
CID 113361832
N-[2-cycloheptyl-3-(3-methylphenyl)propyl]cyclopropanamine
CID 82933526
N-[2-[(5-bromothiophen-2-yl)methyl]-3-(3-methylphenyl)propyl]cyclopropanamine
CID 63521195
N-[2-[(3-methylphenyl)methyl]-4-(trifluoromethylsulfanyl)butyl]cyclopropanamine
CID 116617646
N-[(3-methylphenyl)methyl]cyclopropanamine
CID 16776498
N-[2-[(3-chlorophenyl)methyl]-3-ethoxypropyl]cyclopropanamine
CID 113361839
N-[2-benzyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine
CID 103412311
4-methoxy-2-[(3-methylphenyl)methyl]butan-1-amine
CID 62529986
N-[2-[(3-chlorophenyl)methyl]-3-(2,2,2-trifluoroethoxy)propyl]cyclopropanamine
CID 106705939
N-[2-[(3-fluorophenyl)methyl]pentyl]cyclopropanamine
CID 62528134
N-[2-[(3-methoxyphenyl)methyl]-4-methylsulfonylbutyl]cyclopropanamine
CID 62516818

Frequently Asked Questions

What is the IUPAC name of N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine?
The IUPAC name of N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine (CID 113361834) is N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine.
What is the SMILES notation for N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine?
The canonical SMILES for N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine is COCC(CNC1CC1)Cc1cccc(C)c1.
What is the InChIKey of N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine?
The InChIKey is OOJRBYLMWZWDHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-4-3-5-13(8-12)9-14(11-17-2)10-16-15-6-7-15/h3-5,8,14-16H,6-7,9-11H2,1-2H3.
What are the key properties of N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine?
N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine has a molecular weight of 233.36 g/mol, XLogP of 2.55, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methoxymethyl)-3-(3-methylphenyl)propyl]cyclopropanamine is sourced from PubChem (CID 113361834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).