1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine

C14H21NO2 — CID 43400133

IUPAC1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine
SMILESCOc1ccc(CNC(C)C2CC2)c(OC)c1
InChIInChI=1S/C14H21NO2/c1-10(11-4-5-11)15-9-12-6-7-13(16-2)8-14(12)17-3/h6-8,10-11,15H,4-5,9H2,1-3H3
InChIKeyCJESOMPJGXVZRZ-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.59
Rot. Bonds6

About 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine

1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine (PubChem CID 43400133) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine
PubChem CID43400133
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine
SMILESCOc1ccc(CNC(C)C2CC2)c(OC)c1
InChIInChI=1S/C14H21NO2/c1-10(11-4-5-11)15-9-12-6-7-13(16-2)8-14(12)17-3/h6-8,10-11,15H,4-5,9H2,1-3H3
InChIKeyCJESOMPJGXVZRZ-UHFFFAOYSA-N
XLogP2.59
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)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-[(2,4-dimethoxyphenyl)methyl]-1-(oxan-4-yl)ethanamine
CID 103769004
N-[[2,4-bis(difluoromethoxy)phenyl]methyl]-1-cyclopropylethanamine
CID 43400195
1-cyclopropyl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine
CID 43400170
4-methoxy-2-[[1-(oxan-4-yl)ethylamino]methyl]phenol
CID 103902332
1-(4-chlorophenyl)-N-[(2,4-dimethoxyphenyl)methyl]ethanamine
CID 43079660
N-[(2,4-dimethoxyphenyl)methyl]-2,4-dimethoxyaniline
CID 39427088
N-[(2,4-dimethoxyphenyl)methyl]cyclododecanamine;hydrochloride
CID 21435442
2-[(dicyclopropylmethylamino)methyl]-5-methoxyphenol
CID 61268211
1-(3-chloro-3-cyclopropylpropyl)-2,4-dimethoxybenzene
CID 64507317
N-cyclopentyloxy-1-(2,4-dimethoxyphenyl)methanamine
CID 83228718
N-[(2,4-dimethoxyphenyl)methyl]cyclopropanecarboxamide
CID 47161024
1-cyclopropyl-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]ethanamine
CID 43400202

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine?
The IUPAC name of 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine (CID 43400133) is 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine is COc1ccc(CNC(C)C2CC2)c(OC)c1.
What is the InChIKey of 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine?
The InChIKey is CJESOMPJGXVZRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10(11-4-5-11)15-9-12-6-7-13(16-2)8-14(12)17-3/h6-8,10-11,15H,4-5,9H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine?
1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine has a molecular weight of 235.33 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(2,4-dimethoxyphenyl)methyl]ethanamine is sourced from PubChem (CID 43400133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).