6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine

C16H25NO2 — CID 43537818

IUPAC6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
SMILESCCCNC1c2cc(CCOC)ccc2OCC1C
InChIInChI=1S/C16H25NO2/c1-4-8-17-16-12(2)11-19-15-6-5-13(7-9-18-3)10-14(15)16/h5-6,10,12,16-17H,4,7-9,11H2,1-3H3
InChIKeyQXEZMTBJZXYJHN-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.94
Rot. Bonds6

About 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine

6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine (PubChem CID 43537818) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound Name6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
PubChem CID43537818
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
SMILESCCCNC1c2cc(CCOC)ccc2OCC1C
InChIInChI=1S/C16H25NO2/c1-4-8-17-16-12(2)11-19-15-6-5-13(7-9-18-3)10-14(15)16/h5-6,10,12,16-17H,4,7-9,11H2,1-3H3
InChIKeyQXEZMTBJZXYJHN-UHFFFAOYSA-N
XLogP2.94
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methoxy-5-(2-methoxyethyl)-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83049127
2-ethyl-N-methoxy-5-(2-methoxyethyl)-2,3-dihydro-1-benzofuran-3-amine
CID 81480528
N-[2-(3-fluorophenyl)ethyl]-3-methyl-3,4-dihydro-2H-chromen-4-amine
CID 104523924
5,7-dimethoxy-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 43589774
N-cyclopropyl-6-(2-methoxyethyl)-3,4-dihydro-2H-chromen-4-amine
CID 43512662
5-butyl-N-methoxy-2,3-dihydro-1-benzofuran-3-amine
CID 115492937
N-methyl-5-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 62549578
3-(2-methoxyethylsulfinyl)-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 64652880
N,7-dipropyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 62549764
5-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 43511864
2-ethyl-5-(2-methoxyethyl)-2,3-dihydro-1-benzofuran-3-amine
CID 64662430
N-ethyl-3-methyl-2,3,4,6,7,8-hexahydrocyclopenta[g]chromen-4-amine
CID 43537687

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine (CID 43537818) is 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine is CCCNC1c2cc(CCOC)ccc2OCC1C.
What is the InChIKey of 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is QXEZMTBJZXYJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-8-17-16-12(2)11-19-15-6-5-13(7-9-18-3)10-14(15)16/h5-6,10,12,16-17H,4,7-9,11H2,1-3H3.
What are the key properties of 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine?
6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 263.38 g/mol, XLogP of 2.94, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 43537818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).