1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine

C11H19NO2 — CID 116757355

IUPAC1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine
SMILESCCC(C)(OC)C(N)Cc1ccco1
InChIInChI=1S/C11H19NO2/c1-4-11(2,13-3)10(12)8-9-6-5-7-14-9/h5-7,10H,4,8,12H2,1-3H3
InChIKeyLWNHUFXEBWMLDD-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.96
Rot. Bonds5

About 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine

1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine (PubChem CID 116757355) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine.

Molecular Properties

Compound Name1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine
PubChem CID116757355
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine
SMILESCCC(C)(OC)C(N)Cc1ccco1
InChIInChI=1S/C11H19NO2/c1-4-11(2,13-3)10(12)8-9-6-5-7-14-9/h5-7,10H,4,8,12H2,1-3H3
InChIKeyLWNHUFXEBWMLDD-UHFFFAOYSA-N
XLogP1.96
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-N,3-N-diethyl-1-(furan-2-yl)-3-methylbutane-2,3-diamine
CID 83175566
1-(4-chlorophenyl)-3-methoxy-3-methylpentan-2-amine
CID 116757360
2-(furan-2-ylmethyl)-3,3-dimethylbutan-1-amine
CID 83138308
ethyl 2-amino-3-(furan-2-yl)propanoate
CID 22608494
2-(2-ethylbutyl)furan
CID 68844643
[1-(furan-2-yl)-5-methoxyhexan-2-yl]hydrazine
CID 105331576
1-(furan-2-yl)-5-methoxyhexan-2-ol
CID 105122918
2-(furan-2-yl)ethane-1,1-diol
CID 156698008
[3-ethyl-1-(furan-2-yl)-3-phenylpentan-2-yl]hydrazine
CID 105217733
2-(furan-2-ylmethyl)butan-1-amine
CID 13029329
(2S)-2-(furan-2-ylmethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid
CID 91666114
[1-ethoxy-3-(furan-2-yl)propan-2-yl]hydrazine
CID 105235330

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine?
The IUPAC name of 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine (CID 116757355) is 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine.
What is the SMILES notation for 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine?
The canonical SMILES for 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine is CCC(C)(OC)C(N)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine?
The InChIKey is LWNHUFXEBWMLDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-4-11(2,13-3)10(12)8-9-6-5-7-14-9/h5-7,10H,4,8,12H2,1-3H3.
What are the key properties of 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine?
1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine has a molecular weight of 197.28 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-3-methoxy-3-methylpentan-2-amine is sourced from PubChem (CID 116757355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).