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

C11H21NO2 — CID 102648066

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine
SMILESCCCC(OC)C(N)C1=CCCCO1
InChIInChI=1S/C11H21NO2/c1-3-6-9(13-2)11(12)10-7-4-5-8-14-10/h7,9,11H,3-6,8,12H2,1-2H3
InChIKeyXZNWSFFEUVWBAG-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.82
Rot. Bonds5

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

1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine (PubChem CID 102648066) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine
PubChem CID102648066
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine
SMILESCCCC(OC)C(N)C1=CCCCO1
InChIInChI=1S/C11H21NO2/c1-3-6-9(13-2)11(12)10-7-4-5-8-14-10/h7,9,11H,3-6,8,12H2,1-2H3
InChIKeyXZNWSFFEUVWBAG-UHFFFAOYSA-N
XLogP1.82
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(Z)-6-methoxyoct-6-ene-1,5-diamine
CID 88874149
3,5-Dimethoxycyclohex-2-en-1-amine
CID 91575023
2-[3-(Cyclohexen-1-yloxy)propoxy]ethanamine
CID 140189696
(2R)-2-(cyclohexen-1-yloxy)propan-1-amine
CID 174454430
(2S,3S)-3-methoxy-4-(4-methoxycyclohexa-1,4-dien-1-yl)butan-2-amine
CID 101406327
1-(3,4-dihydro-2H-pyran-6-yl)-2-(oxolan-2-yl)ethanamine
CID 102647129
1-(3,4-dihydro-2H-pyran-6-yl)butan-1-amine
CID 102647141
1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxyethanamine
CID 102647272
1-(3,4-dihydro-2H-pyran-6-yl)-4-methylpentan-1-amine
CID 102647276
1-(3,4-dihydro-2H-pyran-6-yl)-2-propoxyethanamine
CID 102647306
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropan-1-amine
CID 102647488
1-(3,4-dihydro-2H-pyran-6-yl)-4-methoxybutan-1-amine
CID 102647508

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine (CID 102648066) is 1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine is CCCC(OC)C(N)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine?
The InChIKey is XZNWSFFEUVWBAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-6-9(13-2)11(12)10-7-4-5-8-14-10/h7,9,11H,3-6,8,12H2,1-2H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine?
1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxypentan-1-amine has a molecular weight of 199.29 g/mol, XLogP of 1.82, 5 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-methoxypentan-1-amine is sourced from PubChem (CID 102648066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).