N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide

C16H18N2O4 — CID 113060433

IUPACN-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide
SMILESCOc1ccccc1N(CCNC(=O)c1ccco1)C(C)=O
InChIInChI=1S/C16H18N2O4/c1-12(19)18(13-6-3-4-7-14(13)21-2)10-9-17-16(20)15-8-5-11-22-15/h3-8,11H,9-10H2,1-2H3,(H,17,20)
InChIKeyFYQHYZUFXDFFPT-UHFFFAOYSA-N
MW302.33 g/mol
LogP2.07
Rot. Bonds6

About N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide

N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide (PubChem CID 113060433) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide
PubChem CID113060433
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC NameN-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide
SMILESCOc1ccccc1N(CCNC(=O)c1ccco1)C(C)=O
InChIInChI=1S/C16H18N2O4/c1-12(19)18(13-6-3-4-7-14(13)21-2)10-9-17-16(20)15-8-5-11-22-15/h3-8,11H,9-10H2,1-2H3,(H,17,20)
InChIKeyFYQHYZUFXDFFPT-UHFFFAOYSA-N
XLogP2.07
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(N-acetyl-2-ethoxyanilino)ethyl]furan-2-carboxamide
CID 113060744
N-[2-[N-acetyl-2-(trifluoromethyl)anilino]ethyl]furan-2-carboxamide
CID 113061369
methyl N-[2-(N-acetyl-2-methoxyanilino)ethyl]carbamate
CID 113060483
N-[2-(N-acetyl-2-methoxyanilino)ethyl]-4-tert-butylbenzamide
CID 113060452
N-[2-(N-acetyl-4-phenoxyanilino)ethyl]furan-2-carboxamide
CID 113062542
N-[2-(N-acetyl-3-methylanilino)ethyl]furan-2-carboxamide
CID 113057415
N-[2-(N-acetyl-2-fluoroanilino)ethyl]-2,6-dimethoxybenzamide
CID 113059182
N-[2-(N-acetyl-4-propan-2-yloxyanilino)ethyl]furan-2-carboxamide
CID 113061085
N-[2-[2-(2-methoxyphenyl)ethyl-methylsulfonylamino]ethyl]furan-2-carboxamide
CID 113067658
3-(N-acetyl-2-methoxyanilino)-N-benzylpropanamide
CID 113128720
3-(N-acetyl-2-methoxyanilino)-N-[2-(dimethylamino)ethyl]propanamide
CID 113128712
N-[2-(N-acetyl-2,4-dimethoxyanilino)ethyl]-2-phenylacetamide
CID 113061243

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide (CID 113060433) is N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide is COc1ccccc1N(CCNC(=O)c1ccco1)C(C)=O.
What is the InChIKey of N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide?
The InChIKey is FYQHYZUFXDFFPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-12(19)18(13-6-3-4-7-14(13)21-2)10-9-17-16(20)15-8-5-11-22-15/h3-8,11H,9-10H2,1-2H3,(H,17,20).
What are the key properties of N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide?
N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide is sourced from PubChem (CID 113060433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).