1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine

C14H21NO — CID 84786994

IUPAC1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine
SMILESCOc1c(C)ccc(C2(N)CC2)c1C(C)C
InChIInChI=1S/C14H21NO/c1-9(2)12-11(14(15)7-8-14)6-5-10(3)13(12)16-4/h5-6,9H,7-8,15H2,1-4H3
InChIKeyHZKOGGWHTKVXCY-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.07
Rot. Bonds3

About 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine

1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine (PubChem CID 84786994) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine
PubChem CID84786994
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine
SMILESCOc1c(C)ccc(C2(N)CC2)c1C(C)C
InChIInChI=1S/C14H21NO/c1-9(2)12-11(14(15)7-8-14)6-5-10(3)13(12)16-4/h5-6,9H,7-8,15H2,1-4H3
InChIKeyHZKOGGWHTKVXCY-UHFFFAOYSA-N
XLogP3.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine 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

6-(1-aminocyclobutyl)-2-methoxy-3-methylphenol
CID 117296195
1-(2,6-dimethoxy-3-methylphenyl)cyclopropan-1-amine
CID 84779676
1-(2-methoxy-3,4-dimethylphenyl)cycloheptan-1-amine
CID 103432757
2-(3-methoxy-4-methyl-2-propan-2-ylphenyl)propan-1-amine
CID 117317005
1-(3-bromo-2-methoxy-4-methylphenyl)cyclohexan-1-amine
CID 117480335
1-(2,3-dimethoxy-4,5-dimethylphenyl)cyclopropan-1-amine
CID 84788006
1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)ethanol
CID 117297929
1-(2,3-dimethoxy-5-propan-2-ylphenyl)cyclopropan-1-amine
CID 117342983
2-amino-1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)ethanol
CID 84688656
1-[5-(difluoromethyl)-2-methylphenyl]cyclopropan-1-amine
CID 84774294
1-(2-methoxy-3,6-dimethylphenyl)ethanol
CID 117278453
1-(3-bromo-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-amine
CID 84812944

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine?
The IUPAC name of 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine (CID 84786994) is 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine.
What is the SMILES notation for 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine?
The canonical SMILES for 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine is COc1c(C)ccc(C2(N)CC2)c1C(C)C.
What is the InChIKey of 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine?
The InChIKey is HZKOGGWHTKVXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-9(2)12-11(14(15)7-8-14)6-5-10(3)13(12)16-4/h5-6,9H,7-8,15H2,1-4H3.
What are the key properties of 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine?
1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)cyclopropan-1-amine is sourced from PubChem (CID 84786994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).