[1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine

C13H19NO — CID 82283087

IUPAC[1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine
SMILESCOc1ccc(CC2(CN)CC2)cc1C
InChIInChI=1S/C13H19NO/c1-10-7-11(3-4-12(10)15-2)8-13(9-14)5-6-13/h3-4,7H,5-6,8-9,14H2,1-2H3
InChIKeyJNLYNKJWNCSDLJ-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.29
Rot. Bonds4

About [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine

[1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine (PubChem CID 82283087) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine
PubChem CID82283087
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name[1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine
SMILESCOc1ccc(CC2(CN)CC2)cc1C
InChIInChI=1S/C13H19NO/c1-10-7-11(3-4-12(10)15-2)8-13(9-14)5-6-13/h3-4,7H,5-6,8-9,14H2,1-2H3
InChIKeyJNLYNKJWNCSDLJ-UHFFFAOYSA-N
XLogP2.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine 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

[1-[(4-fluoro-3-methylphenyl)methyl]cyclopropyl]methanamine
CID 82401788
[1-[(6-methoxynaphthalen-2-yl)methyl]cyclopropyl]methanamine
CID 116929036
N-[[3-(aminomethyl)oxetan-3-yl]methyl]-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
CID 115249490
[1-[(4-methoxy-3-nitrophenyl)methyl]cyclohexyl]methanamine
CID 65393807
[1-[(3-bromo-4-methoxyphenyl)methyl]-4-ethylcyclohexyl]methanamine
CID 65395564
[3-[(4-methoxy-3-propan-2-ylphenyl)methyl]oxetan-3-yl]methanamine
CID 116930480
3-[(4-methoxy-3-methylphenyl)methyl]pyrrolidin-3-ol
CID 83691069
1-(aminomethyl)-N-[2-(4-methoxy-3-methylphenyl)ethyl]cyclopropane-1-carboxamide
CID 115182752
(4-methoxy-3-methylphenyl)methylphosphane
CID 89138390
(4-methoxy-3-methylphenyl)methylhydrazine
CID 53404033
2-(4-methoxy-3-methylphenyl)-N-[[1-(methylaminomethyl)cyclopropyl]methyl]ethanamine
CID 115244866
3-(4-methoxy-3-methylphenyl)-2-methylpropan-1-amine
CID 83818376

Frequently Asked Questions

What is the IUPAC name of [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine?
The IUPAC name of [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine (CID 82283087) is [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine.
What is the SMILES notation for [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine?
The canonical SMILES for [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine is COc1ccc(CC2(CN)CC2)cc1C.
What is the InChIKey of [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine?
The InChIKey is JNLYNKJWNCSDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-7-11(3-4-12(10)15-2)8-13(9-14)5-6-13/h3-4,7H,5-6,8-9,14H2,1-2H3.
What are the key properties of [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine?
[1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine has a molecular weight of 205.30 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-methoxy-3-methylphenyl)methyl]cyclopropyl]methanamine is sourced from PubChem (CID 82283087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).