6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine

C16H24N2O2 — CID 82626425

IUPAC6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine
SMILESCCOc1ccc2c(c1)C(N1CCCCC1)C(N)CO2
InChIInChI=1S/C16H24N2O2/c1-2-19-12-6-7-15-13(10-12)16(14(17)11-20-15)18-8-4-3-5-9-18/h6-7,10,14,16H,2-5,8-9,11,17H2,1H3
InChIKeyAAPICUZNZVOWAF-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.33
Rot. Bonds3

About 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine

6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine (PubChem CID 82626425) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine.

Molecular Properties

Compound Name6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine
PubChem CID82626425
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine
SMILESCCOc1ccc2c(c1)C(N1CCCCC1)C(N)CO2
InChIInChI=1S/C16H24N2O2/c1-2-19-12-6-7-15-13(10-12)16(14(17)11-20-15)18-8-4-3-5-9-18/h6-7,10,14,16H,2-5,8-9,11,17H2,1H3
InChIKeyAAPICUZNZVOWAF-UHFFFAOYSA-N
XLogP2.33
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethoxy-3-piperidin-1-yl-3,4-dihydro-2H-chromen-4-ol
CID 82187147
6-ethoxy-3-(3-methylpiperidin-1-yl)-3,4-dihydro-2H-chromen-4-ol
CID 82187138
4-(azepan-1-yl)-5,6-dimethyl-3,4-dihydro-2H-chromen-3-amine
CID 82626168
6-methoxy-3-(piperidin-1-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
CID 82188264
5-methyl-6-propan-2-yl-4-pyrrolidin-1-yl-3,4-dihydro-2H-chromen-3-amine
CID 82626173
(4S)-6-ethoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 42130108
3-(dipropylamino)-6-ethoxy-3,4-dihydro-2H-chromen-4-ol
CID 82187139
6-ethoxy-2,3-dihydro-1-benzofuran-3-ol
CID 63096598
(1R,2R)-2-amino-6-ethoxy-2,3-dihydro-1H-inden-1-ol
CID 12051572
3-amino-6-ethoxyspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ol
CID 82020729
(5S)-3-ethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 79014278
3-ethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 62737273

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine?
The IUPAC name of 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine (CID 82626425) is 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine.
What is the SMILES notation for 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine?
The canonical SMILES for 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine is CCOc1ccc2c(c1)C(N1CCCCC1)C(N)CO2.
What is the InChIKey of 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine?
The InChIKey is AAPICUZNZVOWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-2-19-12-6-7-15-13(10-12)16(14(17)11-20-15)18-8-4-3-5-9-18/h6-7,10,14,16H,2-5,8-9,11,17H2,1H3.
What are the key properties of 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine?
6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine has a molecular weight of 276.38 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-amine is sourced from PubChem (CID 82626425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).