6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine

C14H21NO2 — CID 114712931

IUPAC6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
SMILESCNC1CC(C(C)C)Oc2ccc(OC)cc21
InChIInChI=1S/C14H21NO2/c1-9(2)14-8-12(15-3)11-7-10(16-4)5-6-13(11)17-14/h5-7,9,12,14-15H,8H2,1-4H3
InChIKeyRKBSHAWESSNCSN-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.76
Rot. Bonds3

About 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine

6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine (PubChem CID 114712931) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound Name6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
PubChem CID114712931
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
SMILESCNC1CC(C(C)C)Oc2ccc(OC)cc21
InChIInChI=1S/C14H21NO2/c1-9(2)14-8-12(15-3)11-7-10(16-4)5-6-13(11)17-14/h5-7,9,12,14-15H,8H2,1-4H3
InChIKeyRKBSHAWESSNCSN-UHFFFAOYSA-N
XLogP2.76
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-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

7-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 114710884
6-methoxy-N-methyl-2-pentan-3-yl-3,4-dihydro-2H-chromen-4-amine
CID 114712917
2-cyclopropyl-6-methoxy-N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 114712990
6-methoxy-N-methyl-2-(3-methylsulfanylpropyl)-3,4-dihydro-2H-chromen-4-amine
CID 103090686
2-(2-chlorophenyl)-6-methoxy-N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 114712980
N-ethyl-6-methoxy-2-pentan-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 114713069
6-methoxy-2-pentan-3-yl-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 114713104
2-cyclohex-3-en-1-yl-6-methoxy-N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 114712965
2-(4-bromo-5-chlorothiophen-2-yl)-6-methoxy-N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 102846153
5-methoxy-N-propan-2-yl-2,3-dihydro-1-benzofuran-3-amine
CID 43511932
6-methoxy-2-(1-methoxypropan-2-yl)-3,4-dihydro-2H-chromen-4-amine
CID 114709829
6-bromo-N-ethyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 114713390

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine (CID 114712931) is 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine is CNC1CC(C(C)C)Oc2ccc(OC)cc21.
What is the InChIKey of 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is RKBSHAWESSNCSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-9(2)14-8-12(15-3)11-7-10(16-4)5-6-13(11)17-14/h5-7,9,12,14-15H,8H2,1-4H3.
What are the key properties of 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine?
6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 235.33 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-2-propan-2-yl-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 114712931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).