N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine

C11H17NO — CID 79348296

IUPACN-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC=Cc1ccco1
InChIInChI=1S/C11H17NO/c1-11(2,3)12-8-4-6-10-7-5-9-13-10/h4-7,9,12H,8H2,1-3H3
InChIKeyVNJSSDUJNHETNT-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.68
Rot. Bonds3

About N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine

N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine (PubChem CID 79348296) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine
PubChem CID79348296
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameN-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC=Cc1ccco1
InChIInChI=1S/C11H17NO/c1-11(2,3)12-8-4-6-10-7-5-9-13-10/h4-7,9,12H,8H2,1-3H3
InChIKeyVNJSSDUJNHETNT-UHFFFAOYSA-N
XLogP2.68
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(furan-2-yl)-N-methylprop-2-en-1-amine
CID 79347007
butane;(E)-3-(furan-2-yl)-N-methylprop-2-en-1-amine
CID 142079105
N-[(E)-3-(furan-2-yl)prop-2-enyl]-4-methylaniline
CID 115865967
N-[(E)-3-(furan-2-yl)prop-2-enyl]-3,3-dimethylbutan-1-amine
CID 115865915
N-[(E)-3-(furan-2-yl)prop-2-enyl]-2-methyl-2-methylsulfanylpropan-1-amine
CID 115866089
N-[(E)-3-(furan-2-yl)prop-2-enyl]-4-methylthiophen-3-amine
CID 115866144
(2R)-1-[[(E)-3-(furan-2-yl)prop-2-enyl]amino]propan-2-ol
CID 103884288
N-[(E)-3-(furan-2-yl)prop-2-enyl]but-3-en-2-amine
CID 115866111
2-methyl-N-[(E)-3-phenylprop-2-enyl]propan-2-amine
CID 6387609
N-[(E)-3-(furan-2-yl)prop-2-enyl]-5-methylpyridin-2-amine
CID 115865971
N-[(E)-3-(furan-2-yl)prop-2-enyl]-1-methylsulfanylpropan-2-amine
CID 115866050
N-[(E)-3-(furan-2-yl)prop-2-enyl]hexan-1-amine
CID 115865879

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine?
The IUPAC name of N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine (CID 79348296) is N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine is CC(C)(C)NCC=Cc1ccco1.
What is the InChIKey of N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine?
The InChIKey is VNJSSDUJNHETNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-11(2,3)12-8-4-6-10-7-5-9-13-10/h4-7,9,12H,8H2,1-3H3.
What are the key properties of N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine?
N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine has a molecular weight of 179.26 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)prop-2-enyl]-2-methylpropan-2-amine is sourced from PubChem (CID 79348296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).