N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide

C16H18N2O3 — CID 51147843

IUPACN-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
SMILESCC(NC(=O)c1ccco1)C(=O)N(C)Cc1ccccc1
InChIInChI=1S/C16H18N2O3/c1-12(17-15(19)14-9-6-10-21-14)16(20)18(2)11-13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3,(H,17,19)
InChIKeyRDNSNARRTOIDTF-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.06
Rot. Bonds5

About N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide

N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide (PubChem CID 51147843) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
PubChem CID51147843
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
SMILESCC(NC(=O)c1ccco1)C(=O)N(C)Cc1ccccc1
InChIInChI=1S/C16H18N2O3/c1-12(17-15(19)14-9-6-10-21-14)16(20)18(2)11-13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3,(H,17,19)
InChIKeyRDNSNARRTOIDTF-UHFFFAOYSA-N
XLogP2.06
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-1-[(4-ethoxyphenyl)methyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 7831628
N-[(2S)-1-[(3-chlorophenyl)methyl-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 24545173
N-[1-[2-hydroxyethyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 60652573
N-[1-[methyl-[(3-nitrophenyl)methyl]amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 47027180
N-[(2S)-1-[(4-ethylphenyl)methyl-methylamino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 31234949
4-[benzyl-[2-(furan-2-carbonylamino)propanoyl]amino]butanoic acid
CID 120536344
N-[(2S)-1-[[4-(dimethylamino)phenyl]methyl-methylamino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide
CID 34746254
(2S)-2-(furan-2-carbonylamino)propanoic acid
CID 792932
N-[3-methyl-1-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-1-oxobutan-2-yl]furan-2-carboxamide
CID 4878873
2-[tert-butyl-[2-(furan-2-carbonylamino)propanoyl]amino]acetic acid
CID 79262022
N-[benzyl(methyl)carbamothioyl]furan-2-carboxamide
CID 923050
N-[(1S)-1-[benzyl(methyl)amino]-2,2,2-trichloroethyl]furan-2-carboxamide
CID 1159803

Frequently Asked Questions

What is the IUPAC name of N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide (CID 51147843) is N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide is CC(NC(=O)c1ccco1)C(=O)N(C)Cc1ccccc1.
What is the InChIKey of N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide?
The InChIKey is RDNSNARRTOIDTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-12(17-15(19)14-9-6-10-21-14)16(20)18(2)11-13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3,(H,17,19).
What are the key properties of N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide?
N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 51147843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).