3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine

C17H27NO2 — CID 103788453

IUPAC3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine
SMILESCCC(NC1CC(OC)C1(C)C)c1ccccc1OC
InChIInChI=1S/C17H27NO2/c1-6-13(12-9-7-8-10-14(12)19-4)18-15-11-16(20-5)17(15,2)3/h7-10,13,15-16,18H,6,11H2,1-5H3
InChIKeyGWUBRMWXHFWVLM-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.55
Rot. Bonds6

About 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine

3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine (PubChem CID 103788453) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine
PubChem CID103788453
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine
SMILESCCC(NC1CC(OC)C1(C)C)c1ccccc1OC
InChIInChI=1S/C17H27NO2/c1-6-13(12-9-7-8-10-14(12)19-4)18-15-11-16(20-5)17(15,2)3/h7-10,13,15-16,18H,6,11H2,1-5H3
InChIKeyGWUBRMWXHFWVLM-UHFFFAOYSA-N
XLogP3.55
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-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

(1S)-1-(2-methoxyphenyl)-N-[(1S)-1-(2-methoxyphenyl)propyl]propan-1-amine
CID 102356404
2-methoxy-N-[1-(2-methoxyphenyl)propyl]cyclopentan-1-amine
CID 62086587
N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine
CID 43693519
1-cyclopropyl-N-[1-(2-methoxyphenyl)propyl]piperidin-4-amine
CID 43791300
1-cyclopropyl-N-[1-(2-methoxyphenyl)propyl]propan-1-amine
CID 64918822
N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine
CID 66358543
N-[1-(2-methoxyphenyl)propyl]oxan-3-amine
CID 63359926
4-[1-(2-methoxyphenyl)propylamino]pyrrolidin-2-one
CID 114155090
1-(2-methoxyphenyl)-N-propylpropan-1-amine
CID 43279174
N-ethyl-2,2-dimethyl-3-(2-propan-2-ylphenoxy)cyclobutan-1-amine
CID 66359159
1-(2-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106637287
3-ethoxy-2,2-dimethyl-N-[1-(2-methylphenyl)ethyl]cyclobutan-1-amine
CID 64852089

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine?
The IUPAC name of 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine (CID 103788453) is 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine.
What is the SMILES notation for 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine?
The canonical SMILES for 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine is CCC(NC1CC(OC)C1(C)C)c1ccccc1OC.
What is the InChIKey of 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine?
The InChIKey is GWUBRMWXHFWVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-6-13(12-9-7-8-10-14(12)19-4)18-15-11-16(20-5)17(15,2)3/h7-10,13,15-16,18H,6,11H2,1-5H3.
What are the key properties of 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine?
3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine has a molecular weight of 277.41 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine is sourced from PubChem (CID 103788453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).