1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine

C10H19NO2 — CID 102647488

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine
SMILESCCOC(C)C(N)C1=CCCCO1
InChIInChI=1S/C10H19NO2/c1-3-12-8(2)10(11)9-6-4-5-7-13-9/h6,8,10H,3-5,7,11H2,1-2H3
InChIKeyLHNKORJDINOVLT-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.43
Rot. Bonds4

About 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine

1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine (PubChem CID 102647488) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine
PubChem CID102647488
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine
SMILESCCOC(C)C(N)C1=CCCCO1
InChIInChI=1S/C10H19NO2/c1-3-12-8(2)10(11)9-6-4-5-7-13-9/h6,8,10H,3-5,7,11H2,1-2H3
InChIKeyLHNKORJDINOVLT-UHFFFAOYSA-N
XLogP1.43
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine (CID 102647488) is 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine is CCOC(C)C(N)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine?
The InChIKey is LHNKORJDINOVLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-12-8(2)10(11)9-6-4-5-7-13-9/h6,8,10H,3-5,7,11H2,1-2H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine?
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine has a molecular weight of 185.27 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine is sourced from PubChem (CID 102647488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).