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

C11H15NO2 — CID 81482054

IUPACN-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine
SMILESCONC1CCOc2ccc(C)cc21
InChIInChI=1S/C11H15NO2/c1-8-3-4-11-9(7-8)10(12-13-2)5-6-14-11/h3-4,7,10,12H,5-6H2,1-2H3
InChIKeyKBSGUZZYNHJEHG-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.97
Rot. Bonds2

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

N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine (PubChem CID 81482054) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound NameN-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine
PubChem CID81482054
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC NameN-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine
SMILESCONC1CCOc2ccc(C)cc21
InChIInChI=1S/C11H15NO2/c1-8-3-4-11-9(7-8)10(12-13-2)5-6-14-11/h3-4,7,10,12H,5-6H2,1-2H3
InChIKeyKBSGUZZYNHJEHG-UHFFFAOYSA-N
XLogP1.97
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methoxy-6-propoxy-3,4-dihydro-2H-chromen-4-amine
CID 81481795
7-chloro-N-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 81481829
2-methoxy-4,5-dimethyl-N-(6-methyl-3,4-dihydro-2H-chromen-4-yl)benzenesulfonamide
CID 108781694
N-methoxy-7-(2-methylbutan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 81481929
2,2,2-trichloro-N-(6-methyl-3,4-dihydro-2H-chromen-4-yl)acetamide
CID 108734077
2-(3,4-dimethoxyphenyl)-N-(6-methyl-3,4-dihydro-2H-chromen-4-yl)acetamide
CID 108734105
2-chloro-N-(6-methyl-3,4-dihydro-2H-chromen-4-yl)propanamide
CID 108734122
6-methoxy-N-[(2-methylpropan-2-yl)oxy]-3,4-dihydro-2H-chromen-4-amine
CID 82720276
N-(2-chloro-4-methylphenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 43772699
N',N'-diethyl-N-(6-methyl-3,4-dihydro-2H-chromen-4-yl)propane-1,3-diamine
CID 82461432
(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene
CID 167327532
7-butyl-N-methoxy-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 113322712

Frequently Asked Questions

What is the IUPAC name of N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine (CID 81482054) is N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine is CONC1CCOc2ccc(C)cc21.
What is the InChIKey of N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is KBSGUZZYNHJEHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8-3-4-11-9(7-8)10(12-13-2)5-6-14-11/h3-4,7,10,12H,5-6H2,1-2H3.
What are the key properties of N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine?
N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 193.25 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 81482054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).