1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine

C10H19NO2 — CID 105179232

IUPAC1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine
SMILESCC(C)OCC(N)C1=COCCC1
InChIInChI=1S/C10H19NO2/c1-8(2)13-7-10(11)9-4-3-5-12-6-9/h6,8,10H,3-5,7,11H2,1-2H3
InChIKeyULMPWTUIKUNLJG-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.43
Rot. Bonds4

About 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine

1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine (PubChem CID 105179232) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine
PubChem CID105179232
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine
SMILESCC(C)OCC(N)C1=COCCC1
InChIInChI=1S/C10H19NO2/c1-8(2)13-7-10(11)9-4-3-5-12-6-9/h6,8,10H,3-5,7,11H2,1-2H3
InChIKeyULMPWTUIKUNLJG-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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Related Compounds

1-(3,4-dihydro-2H-pyran-5-yl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103216169
1-(3,4-dihydro-2H-pyran-5-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
CID 103475118
2-Methyl-1-(oxolan-2-yl)prop-2-en-1-amine
CID 79179909
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypentan-1-amine
CID 102648063
1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine
CID 102648066
1-(3,4-dihydro-2H-pyran-5-yl)-3-methoxypropan-1-amine
CID 104058661
1-(3,4-dihydro-2H-pyran-5-yl)-2-methoxyethanamine
CID 104058671
1-(3,4-dihydro-2H-pyran-5-yl)-2-methoxy-N-methylethanamine
CID 104058672
1-(3,4-dihydro-2H-pyran-5-yl)-2-propoxyethanamine
CID 104058705
1-(3,4-dihydro-2H-pyran-5-yl)-N-methyl-2-propoxyethanamine
CID 104058706
1-(3,4-dihydro-2H-pyran-5-yl)-N-ethyl-2-propoxyethanamine
CID 104058707
N-[1-(3,4-dihydro-2H-pyran-5-yl)-2-propoxyethyl]propan-1-amine
CID 104058708

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine (CID 105179232) is 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine is CC(C)OCC(N)C1=COCCC1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine?
The InChIKey is ULMPWTUIKUNLJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8(2)13-7-10(11)9-4-3-5-12-6-9/h6,8,10H,3-5,7,11H2,1-2H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine?
1-(3,4-dihydro-2H-pyran-5-yl)-2-propan-2-yloxyethanamine 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-5-yl)-2-propan-2-yloxyethanamine is sourced from PubChem (CID 105179232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).