(Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide

C8H10N2O2 — CID 153336200

IUPAC(Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide
SMILESCN/C=C(\C(N)=O)c1ccco1
InChIInChI=1S/C8H10N2O2/c1-10-5-6(8(9)11)7-3-2-4-12-7/h2-5,10H,1H3,(H2,9,11)/b6-5-
InChIKeyBBQRPJIHMMQDAW-WAYWQWQTSA-N
MW166.18 g/mol
LogP0.33
Rot. Bonds3

About (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide

(Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide (PubChem CID 153336200) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide.

Molecular Properties

Compound Name(Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide
PubChem CID153336200
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name(Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide
SMILESCN/C=C(\C(N)=O)c1ccco1
InChIInChI=1S/C8H10N2O2/c1-10-5-6(8(9)11)7-3-2-4-12-7/h2-5,10H,1H3,(H2,9,11)/b6-5-
InChIKeyBBQRPJIHMMQDAW-WAYWQWQTSA-N
XLogP0.33
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide?
The IUPAC name of (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide (CID 153336200) is (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide.
What is the SMILES notation for (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide?
The canonical SMILES for (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide is CN/C=C(\C(N)=O)c1ccco1.
What is the InChIKey of (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide?
The InChIKey is BBQRPJIHMMQDAW-WAYWQWQTSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-10-5-6(8(9)11)7-3-2-4-12-7/h2-5,10H,1H3,(H2,9,11)/b6-5-.
What are the key properties of (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide?
(Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide has a molecular weight of 166.18 g/mol, XLogP of 0.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(furan-2-yl)-3-(methylamino)prop-2-enamide is sourced from PubChem (CID 153336200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).