2-(furan-2-ylmethyl)prop-2-en-1-amine

C8H11NO — CID 117266490

IUPAC2-(furan-2-ylmethyl)prop-2-en-1-amine
SMILESC=C(CN)Cc1ccco1
InChIInChI=1S/C8H11NO/c1-7(6-9)5-8-3-2-4-10-8/h2-4H,1,5-6,9H2
InChIKeyAAJFIEZGBSRBJZ-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.34
Rot. Bonds3

About 2-(furan-2-ylmethyl)prop-2-en-1-amine

2-(furan-2-ylmethyl)prop-2-en-1-amine (PubChem CID 117266490) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 2-(furan-2-ylmethyl)prop-2-en-1-amine.

Molecular Properties

Compound Name2-(furan-2-ylmethyl)prop-2-en-1-amine
PubChem CID117266490
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name2-(furan-2-ylmethyl)prop-2-en-1-amine
SMILESC=C(CN)Cc1ccco1
InChIInChI=1S/C8H11NO/c1-7(6-9)5-8-3-2-4-10-8/h2-4H,1,5-6,9H2
InChIKeyAAJFIEZGBSRBJZ-UHFFFAOYSA-N
XLogP1.34
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

furan-2-ylmethanamine;methane
CID 20976999
2-(furan-2-ylmethyl)prop-2-enal
CID 117266840
1-[4-(aminomethyl)phenyl]-2-(furan-2-yl)ethanone
CID 116548254
2-(furan-2-ylmethoxymethyl)prop-2-ene-1-thiol
CID 103073671
2-(furan-2-yl)ethane-1,1-diol
CID 156698008
4-(furan-2-yl)but-2-en-1-amine
CID 70478448
3-amino-1-(furan-2-yl)-3-methylbutan-2-one
CID 82413823
2-amino-N-(furan-2-ylmethyl)acetamide
CID 7130773
4-[2-(furan-2-ylmethyl)prop-2-enoyloxy]-2-methylidenebutanoic acid
CID 70348245
(NE)-N-[1-(furan-2-yl)propan-2-ylidene]hydroxylamine
CID 15581316
furan-2-ylmethanamine;4-(hydroxymethyl)phenol
CID 175459572
1-cyclopropyl-2-(furan-2-yl)ethanone
CID 83172331

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethyl)prop-2-en-1-amine?
The IUPAC name of 2-(furan-2-ylmethyl)prop-2-en-1-amine (CID 117266490) is 2-(furan-2-ylmethyl)prop-2-en-1-amine.
What is the SMILES notation for 2-(furan-2-ylmethyl)prop-2-en-1-amine?
The canonical SMILES for 2-(furan-2-ylmethyl)prop-2-en-1-amine is C=C(CN)Cc1ccco1.
What is the InChIKey of 2-(furan-2-ylmethyl)prop-2-en-1-amine?
The InChIKey is AAJFIEZGBSRBJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-7(6-9)5-8-3-2-4-10-8/h2-4H,1,5-6,9H2.
What are the key properties of 2-(furan-2-ylmethyl)prop-2-en-1-amine?
2-(furan-2-ylmethyl)prop-2-en-1-amine has a molecular weight of 137.18 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethyl)prop-2-en-1-amine is sourced from PubChem (CID 117266490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).