(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide

C9H11NO2 — CID 11480633

IUPAC(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide
SMILESCN(C)C(=O)/C=C/c1ccco1
InChIInChI=1S/C9H11NO2/c1-10(2)9(11)6-5-8-4-3-7-12-8/h3-7H,1-2H3/b6-5+
InChIKeyQKBTWUHOINANFF-AATRIKPKSA-N
MW165.19 g/mol
LogP1.38
Rot. Bonds2

About (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide

(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide (PubChem CID 11480633) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide
PubChem CID11480633
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide
SMILESCN(C)C(=O)/C=C/c1ccco1
InChIInChI=1S/C9H11NO2/c1-10(2)9(11)6-5-8-4-3-7-12-8/h3-7H,1-2H3/b6-5+
InChIKeyQKBTWUHOINANFF-AATRIKPKSA-N
XLogP1.38
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-(furan-2-yl)-N-methyl-N-(2-methylbutan-2-yl)prop-2-enamide
CID 70870521
(E)-3-(furan-2-yl)-N,N-bis(2-methylpropyl)prop-2-enamide
CID 6000305
CID 59090942
CID 59090942
3-(furan-2-yl)prop-2-enoic acid
CID 159116571
N-[2-(dimethylamino)-2-oxoethyl]-3-(furan-2-yl)-N-(2,2,2-trifluoroethyl)prop-2-enamide
CID 103597968
(E)-N,N-dibenzyl-3-(furan-2-yl)prop-2-enamide
CID 790450
(E)-3-(furan-2-yl)-N-[2-(N-[(E)-3-(furan-2-yl)prop-2-enoyl]anilino)ethyl]-N-phenylprop-2-enamide
CID 6132853
3-(furan-2-yl)prop-2-enoyl chloride
CID 53411285
methyl 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]-methylamino]benzoate
CID 43409527
3-(furan-2-yl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]prop-2-enamide
CID 102603432
(2Z,4E)-5-(furan-2-yl)-3-methylpenta-2,4-dienoic acid
CID 774945
N-benzyl-N-[2-[benzyl-[3-(furan-2-yl)prop-2-enoyl]amino]ethyl]-3-(furan-2-yl)prop-2-enamide
CID 2920998

Frequently Asked Questions

What is the IUPAC name of (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide?
The IUPAC name of (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide (CID 11480633) is (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide.
What is the SMILES notation for (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide?
The canonical SMILES for (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide is CN(C)C(=O)/C=C/c1ccco1.
What is the InChIKey of (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide?
The InChIKey is QKBTWUHOINANFF-AATRIKPKSA-N. The full InChI is InChI=1S/C9H11NO2/c1-10(2)9(11)6-5-8-4-3-7-12-8/h3-7H,1-2H3/b6-5+.
What are the key properties of (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide?
(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide has a molecular weight of 165.19 g/mol, XLogP of 1.38, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide is sourced from PubChem (CID 11480633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).