N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide

C19H20N2O4 — CID 46421801

IUPACN-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide
SMILESCC(NC(=O)c1ccco1)C(=O)N(C)C(C)c1cc2ccccc2o1
InChIInChI=1S/C19H20N2O4/c1-12(20-18(22)16-9-6-10-24-16)19(23)21(3)13(2)17-11-14-7-4-5-8-15(14)25-17/h4-13H,1-3H3,(H,20,22)
InChIKeyFFNCSTWLYVQAGL-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.36
Rot. Bonds5

About N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide

N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide (PubChem CID 46421801) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide
PubChem CID46421801
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide
SMILESCC(NC(=O)c1ccco1)C(=O)N(C)C(C)c1cc2ccccc2o1
InChIInChI=1S/C19H20N2O4/c1-12(20-18(22)16-9-6-10-24-16)19(23)21(3)13(2)17-11-14-7-4-5-8-15(14)25-17/h4-13H,1-3H3,(H,20,22)
InChIKeyFFNCSTWLYVQAGL-UHFFFAOYSA-N
XLogP3.36
TPSA75.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-(1-benzofuran-2-yl)ethyl]furan-2-carboxamide
CID 41095457
N-[1-(1-benzofuran-2-yl)ethyl]-2-methoxy-N-methylpropanamide
CID 115588204
(2S)-2-amino-N-[1-(1-benzofuran-2-yl)ethyl]-N,3-dimethylbutanamide
CID 61164290
N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 51147843
N-[4-[[(1R)-1-(1-benzofuran-2-yl)ethyl]carbamoyl]phenyl]furan-2-carboxamide
CID 9368629
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 9366962
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 9366960
3-[1-(1-benzofuran-2-yl)ethyl-methylamino]-3-oxopropanoic acid
CID 55049773
N-[1-[2-hydroxyethyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 60652573
N-[1-[3-(1-benzofuran-2-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide
CID 71921726
N-[5-[[(1R)-1-(1-benzofuran-2-yl)ethyl]carbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 31310103
N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide
CID 46551065

Frequently Asked Questions

What is the IUPAC name of N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide (CID 46421801) is N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide is CC(NC(=O)c1ccco1)C(=O)N(C)C(C)c1cc2ccccc2o1.
What is the InChIKey of N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide?
The InChIKey is FFNCSTWLYVQAGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-12(20-18(22)16-9-6-10-24-16)19(23)21(3)13(2)17-11-14-7-4-5-8-15(14)25-17/h4-13H,1-3H3,(H,20,22).
What are the key properties of N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide?
N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide has a molecular weight of 340.38 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[1-(1-benzofuran-2-yl)ethyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 46421801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).