N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide

C15H18N2O2 — CID 31544582

IUPACN-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide
SMILESCN(C)Cc1ccc(CNC(=O)c2ccoc2)cc1
InChIInChI=1S/C15H18N2O2/c1-17(2)10-13-5-3-12(4-6-13)9-16-15(18)14-7-8-19-11-14/h3-8,11H,9-10H2,1-2H3,(H,16,18)
InChIKeyOILLNINYDGXPNH-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.27
Rot. Bonds5

About N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide

N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide (PubChem CID 31544582) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide
PubChem CID31544582
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide
SMILESCN(C)Cc1ccc(CNC(=O)c2ccoc2)cc1
InChIInChI=1S/C15H18N2O2/c1-17(2)10-13-5-3-12(4-6-13)9-16-15(18)14-7-8-19-11-14/h3-8,11H,9-10H2,1-2H3,(H,16,18)
InChIKeyOILLNINYDGXPNH-UHFFFAOYSA-N
XLogP2.27
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-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-[[4-(propan-2-yloxymethyl)phenyl]methyl]furan-3-carboxamide
CID 47043832
N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide
CID 24532506
N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]furan-3-carboxamide
CID 18153751
N-[[3-(diethylaminomethyl)phenyl]methyl]furan-3-carboxamide
CID 47046081
N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]furan-3-carboxamide
CID 39997651
N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]furan-3-carboxamide
CID 53159097
N-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]furan-3-carboxamide
CID 18149564
N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]furan-3-carboxamide
CID 18132522
3-[(furan-3-carbonylamino)methyl]benzoic acid
CID 60894235
N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furan-3-carboxamide
CID 46450029
methyl 5-[(furan-3-carbonylamino)methyl]-2-methoxybenzoate
CID 51265623
N-[(4-aminophenyl)methyl]-N-methylfuran-3-carboxamide
CID 43458127

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide?
The IUPAC name of N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide (CID 31544582) is N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide.
What is the SMILES notation for N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide?
The canonical SMILES for N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide is CN(C)Cc1ccc(CNC(=O)c2ccoc2)cc1.
What is the InChIKey of N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide?
The InChIKey is OILLNINYDGXPNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-17(2)10-13-5-3-12(4-6-13)9-16-15(18)14-7-8-19-11-14/h3-8,11H,9-10H2,1-2H3,(H,16,18).
What are the key properties of N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide?
N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide is sourced from PubChem (CID 31544582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).