N,N-dimethyl-5-(methylamino)furan-2-carboxamide

C8H12N2O2 — CID 45119710

IUPACN,N-dimethyl-5-(methylamino)furan-2-carboxamide
SMILESCNc1ccc(C(=O)N(C)C)o1
InChIInChI=1S/C8H12N2O2/c1-9-7-5-4-6(12-7)8(11)10(2)3/h4-5,9H,1-3H3
InChIKeyKCLVVFISCBEWHU-UHFFFAOYSA-N
MW168.20 g/mol
LogP1.02
Rot. Bonds2

About N,N-dimethyl-5-(methylamino)furan-2-carboxamide

N,N-dimethyl-5-(methylamino)furan-2-carboxamide (PubChem CID 45119710) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is N,N-dimethyl-5-(methylamino)furan-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-5-(methylamino)furan-2-carboxamide
PubChem CID45119710
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC NameN,N-dimethyl-5-(methylamino)furan-2-carboxamide
SMILESCNc1ccc(C(=O)N(C)C)o1
InChIInChI=1S/C8H12N2O2/c1-9-7-5-4-6(12-7)8(11)10(2)3/h4-5,9H,1-3H3
InChIKeyKCLVVFISCBEWHU-UHFFFAOYSA-N
XLogP1.02
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-5-(methylamino)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

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-(methylamino)furan-2-carboxamide?
The IUPAC name of N,N-dimethyl-5-(methylamino)furan-2-carboxamide (CID 45119710) is N,N-dimethyl-5-(methylamino)furan-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-5-(methylamino)furan-2-carboxamide?
The canonical SMILES for N,N-dimethyl-5-(methylamino)furan-2-carboxamide is CNc1ccc(C(=O)N(C)C)o1.
What is the InChIKey of N,N-dimethyl-5-(methylamino)furan-2-carboxamide?
The InChIKey is KCLVVFISCBEWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-9-7-5-4-6(12-7)8(11)10(2)3/h4-5,9H,1-3H3.
What are the key properties of N,N-dimethyl-5-(methylamino)furan-2-carboxamide?
N,N-dimethyl-5-(methylamino)furan-2-carboxamide has a molecular weight of 168.20 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-(methylamino)furan-2-carboxamide is sourced from PubChem (CID 45119710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).