3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine

C14H19NO2 — CID 104768849

IUPAC3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine
SMILESNC1CC(OCC2CCOc3ccccc32)C1
InChIInChI=1S/C14H19NO2/c15-11-7-12(8-11)17-9-10-5-6-16-14-4-2-1-3-13(10)14/h1-4,10-12H,5-9,15H2
InChIKeyRCSGXHVQMZHUEQ-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.06
Rot. Bonds3

About 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine

3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine (PubChem CID 104768849) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine.

Molecular Properties

Compound Name3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine
PubChem CID104768849
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine
SMILESNC1CC(OCC2CCOc3ccccc32)C1
InChIInChI=1S/C14H19NO2/c15-11-7-12(8-11)17-9-10-5-6-16-14-4-2-1-3-13(10)14/h1-4,10-12H,5-9,15H2
InChIKeyRCSGXHVQMZHUEQ-UHFFFAOYSA-N
XLogP2.06
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-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

3-(2,3-dihydro-1-benzofuran-3-ylmethoxy)cyclopentan-1-amine
CID 79465588
4-(2,3-dihydro-1-benzofuran-3-ylmethoxy)cyclohexan-1-amine
CID 79230039
[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887493
[(4S)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887495
3-(3,4-dihydro-2H-chromen-4-ylmethyl)cycloheptan-1-amine
CID 104771828
(1S)-1-[2-(3,4-dihydro-2H-chromen-4-ylmethoxy)phenyl]ethanamine
CID 104768135
1-cyclopropyl-N-(3,4-dihydro-2H-chromen-4-ylmethyl)methanamine
CID 63708653
(4R)-4-(iodomethyl)-3,4-dihydro-2H-chromene
CID 92908096
2-(3,4-dihydro-2H-chromen-4-ylmethoxy)phenol
CID 104768812
[4-(3,4-dihydro-2H-chromen-4-ylmethoxy)phenyl]methanamine
CID 104768013
2-(3,4-dihydro-2H-chromen-4-yl)ethanamine;hydrochloride
CID 175798234
4-[(4-fluorophenoxy)methyl]-3,4-dihydro-2H-chromene
CID 104771987

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine?
The IUPAC name of 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine (CID 104768849) is 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine.
What is the SMILES notation for 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine?
The canonical SMILES for 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine is NC1CC(OCC2CCOc3ccccc32)C1.
What is the InChIKey of 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine?
The InChIKey is RCSGXHVQMZHUEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c15-11-7-12(8-11)17-9-10-5-6-16-14-4-2-1-3-13(10)14/h1-4,10-12H,5-9,15H2.
What are the key properties of 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine?
3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine has a molecular weight of 233.31 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclobutan-1-amine is sourced from PubChem (CID 104768849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).