1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine

C9H17NO2 — CID 102651911

IUPAC1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine
SMILESCNC(C1=CCCO1)C(C)OC
InChIInChI=1S/C9H17NO2/c1-7(11-3)9(10-2)8-5-4-6-12-8/h5,7,9-10H,4,6H2,1-3H3
InChIKeyLRADVZNIFXIXDI-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.91
Rot. Bonds4

About 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine

1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine (PubChem CID 102651911) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine
PubChem CID102651911
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine
SMILESCNC(C1=CCCO1)C(C)OC
InChIInChI=1S/C9H17NO2/c1-7(11-3)9(10-2)8-5-4-6-12-8/h5,7,9-10H,4,6H2,1-3H3
InChIKeyLRADVZNIFXIXDI-UHFFFAOYSA-N
XLogP0.91
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-propylpropan-1-amine
CID 102651913
1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine
CID 102651545
1-(2,3-dihydrofuran-5-yl)-2-methoxypropan-1-ol
CID 102653906
1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-N-propylpropan-1-amine
CID 102647801
1-(2,3-dihydrofuran-5-yl)-N-ethyl-2-methoxybutan-1-amine
CID 102652185
2-cyclopropyl-1-(2,3-dihydrofuran-5-yl)-2-ethoxy-N-methylethanamine
CID 102652211
1-(2,3-dihydrofuran-5-yl)-2-methoxy-3-methylbutan-1-ol
CID 102654877
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methoxy-N-methylpropan-1-amine
CID 79617292
1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine
CID 102653078
1-(2,3-dihydrofuran-5-yl)-1-(2-methoxy-3-pyridinyl)-N-methylmethanamine
CID 102653191
1-(2,3-dihydrofuran-5-yl)-N-ethyl-2-methylsulfonylpropan-1-amine
CID 102653734
1-(2,3-dihydrofuran-5-yl)-1-(furan-3-yl)-N-methylmethanamine
CID 102651572

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine (CID 102651911) is 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine is CNC(C1=CCCO1)C(C)OC.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine?
The InChIKey is LRADVZNIFXIXDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-7(11-3)9(10-2)8-5-4-6-12-8/h5,7,9-10H,4,6H2,1-3H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine?
1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine has a molecular weight of 171.24 g/mol, XLogP of 0.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine is sourced from PubChem (CID 102651911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).