2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide

C13H19ClN2O2 — CID 106686782

IUPAC2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide
SMILESCC(CNC(=O)c1ccoc1Cl)CN1CCCC1
InChIInChI=1S/C13H19ClN2O2/c1-10(9-16-5-2-3-6-16)8-15-13(17)11-4-7-18-12(11)14/h4,7,10H,2-3,5-6,8-9H2,1H3,(H,15,17)
InChIKeyMUFFFNFYUMDRLM-UHFFFAOYSA-N
MW270.76 g/mol
LogP2.39
Rot. Bonds5

About 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide

2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide (PubChem CID 106686782) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide
PubChem CID106686782
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC Name2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide
SMILESCC(CNC(=O)c1ccoc1Cl)CN1CCCC1
InChIInChI=1S/C13H19ClN2O2/c1-10(9-16-5-2-3-6-16)8-15-13(17)11-4-7-18-12(11)14/h4,7,10H,2-3,5-6,8-9H2,1H3,(H,15,17)
InChIKeyMUFFFNFYUMDRLM-UHFFFAOYSA-N
XLogP2.39
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)furan-3-carboxamide
CID 106853640
2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide
CID 106685808
5-chloro-2-hydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 47308839
N-(2-bromopropyl)-2-chlorofuran-3-carboxamide
CID 106690037
N-(2-aminopropyl)-2-chlorofuran-3-carboxamide
CID 106688502
2-chloro-N-(2-methyl-3-morpholin-4-ylpropyl)benzamide
CID 110441973
2-amino-5-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 61139853
4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide
CID 61051288
5-ethyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,3-oxazole-4-carboxamide
CID 139003076
3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide
CID 115646380
5-bromo-2-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 65309537
1-(4-chlorophenyl)-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 55878361

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide (CID 106686782) is 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide is CC(CNC(=O)c1ccoc1Cl)CN1CCCC1.
What is the InChIKey of 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide?
The InChIKey is MUFFFNFYUMDRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c1-10(9-16-5-2-3-6-16)8-15-13(17)11-4-7-18-12(11)14/h4,7,10H,2-3,5-6,8-9H2,1H3,(H,15,17).
What are the key properties of 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide?
2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide has a molecular weight of 270.76 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide is sourced from PubChem (CID 106686782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).