5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide

C12H18N2O2 — CID 104972070

IUPAC5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
SMILESCc1ccc(C(=O)NCC[C@H]2CCCN2)o1
InChIInChI=1S/C12H18N2O2/c1-9-4-5-11(16-9)12(15)14-8-6-10-3-2-7-13-10/h4-5,10,13H,2-3,6-8H2,1H3,(H,14,15)/t10-/m1/s1
InChIKeyGXWAHXLUBCHXIF-SNVBAGLBSA-N
MW222.29 g/mol
LogP1.46
Rot. Bonds4

About 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide

5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide (PubChem CID 104972070) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
PubChem CID104972070
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
SMILESCc1ccc(C(=O)NCC[C@H]2CCCN2)o1
InChIInChI=1S/C12H18N2O2/c1-9-4-5-11(16-9)12(15)14-8-6-10-3-2-7-13-10/h4-5,10,13H,2-3,6-8H2,1H3,(H,14,15)/t10-/m1/s1
InChIKeyGXWAHXLUBCHXIF-SNVBAGLBSA-N
XLogP1.46
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
CID 104972060
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-1-benzofuran-2-carboxamide
CID 104955292
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1-benzofuran-2-carboxamide
CID 104972010
2,5-dimethyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793749
5-ethyl-N-(pyrrolidin-2-ylmethyl)furan-2-carboxamide
CID 79095320
4-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]chromene-2-carboxamide
CID 104955209
1-(5-methylfuran-2-yl)-2-piperidin-2-ylethanone
CID 79538933
1-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrrole-2-carboxamide
CID 104955194
3-bromo-4-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793684
2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
CID 104972264
5-fluoro-2-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793819
N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)furan-2-carboxamide
CID 106608715

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide?
The IUPAC name of 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide (CID 104972070) is 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide?
The canonical SMILES for 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide is Cc1ccc(C(=O)NCC[C@H]2CCCN2)o1.
What is the InChIKey of 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide?
The InChIKey is GXWAHXLUBCHXIF-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-4-5-11(16-9)12(15)14-8-6-10-3-2-7-13-10/h4-5,10,13H,2-3,6-8H2,1H3,(H,14,15)/t10-/m1/s1.
What are the key properties of 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide?
5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide is sourced from PubChem (CID 104972070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).