2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide

C12H18N2O2 — CID 93274596

IUPAC2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide
SMILESCc1cc(C(=O)N[C@H]2CCCNC2)c(C)o1
InChIInChI=1S/C12H18N2O2/c1-8-6-11(9(2)16-8)12(15)14-10-4-3-5-13-7-10/h6,10,13H,3-5,7H2,1-2H3,(H,14,15)/t10-/m0/s1
InChIKeyXMMYNZLVCHBNGC-JTQLQIEISA-N
MW222.29 g/mol
LogP1.38
Rot. Bonds2

About 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide

2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide (PubChem CID 93274596) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide
PubChem CID93274596
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide
SMILESCc1cc(C(=O)N[C@H]2CCCNC2)c(C)o1
InChIInChI=1S/C12H18N2O2/c1-8-6-11(9(2)16-8)12(15)14-10-4-3-5-13-7-10/h6,10,13H,3-5,7H2,1-2H3,(H,14,15)/t10-/m0/s1
InChIKeyXMMYNZLVCHBNGC-JTQLQIEISA-N
XLogP1.38
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,5-dimethyl-N-[(3S)-piperidin-3-yl]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

2,5-dimethyl-N-piperidin-3-ylfuran-3-carboxamide;hydrochloride
CID 119427545
2,5-dimethyl-N-pyrrolidin-3-ylfuran-3-carboxamide
CID 43603617
N-[(3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-yl]-2,5-dimethylfuran-3-carboxamide
CID 43603808
5-methyl-N-piperidin-3-ylfuran-2-carboxamide
CID 43603726
2,5-dimethyl-N-(2-methylpiperidin-4-yl)furan-3-carboxamide;hydrochloride
CID 120600731
4-fluoro-2-methyl-N-[(3R)-piperidin-3-yl]benzamide
CID 113436694
4-(dimethylsulfamoyl)-5-methyl-N-piperidin-3-ylfuran-2-carboxamide
CID 119429351
4-methyl-N-piperidin-3-yl-1,3-oxazole-5-carboxamide
CID 81471254
2,5-dimethyl-N-(piperidin-4-ylmethyl)furan-3-carboxamide
CID 60725294
N-[4-(ethylamino)cyclohexyl]-2,5-dimethylfuran-3-carboxamide
CID 43653345
2,4,5-trimethoxy-N-piperidin-3-ylbenzamide;hydrochloride
CID 119426612
2-methyl-5-methylsulfanyl-N-piperidin-3-ylbenzamide;hydrochloride
CID 119426358

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide (CID 93274596) is 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide is Cc1cc(C(=O)N[C@H]2CCCNC2)c(C)o1.
What is the InChIKey of 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide?
The InChIKey is XMMYNZLVCHBNGC-JTQLQIEISA-N. The full InChI is InChI=1S/C12H18N2O2/c1-8-6-11(9(2)16-8)12(15)14-10-4-3-5-13-7-10/h6,10,13H,3-5,7H2,1-2H3,(H,14,15)/t10-/m0/s1.
What are the key properties of 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide?
2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[(3S)-piperidin-3-yl]furan-3-carboxamide is sourced from PubChem (CID 93274596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).