2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine

C12H19NO — CID 83907601

IUPAC2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine
SMILESCc1ccc(C(C)CC2CCCN2)o1
InChIInChI=1S/C12H19NO/c1-9(8-11-4-3-7-13-11)12-6-5-10(2)14-12/h5-6,9,11,13H,3-4,7-8H2,1-2H3
InChIKeyMPTZXOOETNTARY-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.83
Rot. Bonds3

About 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine

2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine (PubChem CID 83907601) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine.

Molecular Properties

Compound Name2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine
PubChem CID83907601
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine
SMILESCc1ccc(C(C)CC2CCCN2)o1
InChIInChI=1S/C12H19NO/c1-9(8-11-4-3-7-13-11)12-6-5-10(2)14-12/h5-6,9,11,13H,3-4,7-8H2,1-2H3
InChIKeyMPTZXOOETNTARY-UHFFFAOYSA-N
XLogP2.83
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-5-(1-pyrrolidin-2-ylpropan-2-yl)pyrazole
CID 112715167
2-(2-thiophen-2-ylpropyl)pyrrolidine
CID 112715427
2-methyl-5-(1-pyrrolidin-2-ylpropan-2-yl)pyridine
CID 83908692
(2S)-2-(2-methylpropyl)pyrrolidine;molecular hydrogen
CID 142042486
6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
CID 116971067
2-[2,2-difluoro-2-(5-methylfuran-2-yl)ethyl]pyrrolidine
CID 116840169
2-(1-pyrrolidin-2-ylpropan-2-yl)pyridine
CID 83907313
1-(5-methylfuran-2-yl)-2-piperidin-2-ylethanone
CID 79538933
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79541452
5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
CID 104972070
1-(azepan-2-yl)-N-[(5-methylfuran-2-yl)methyl]methanamine
CID 64570983
N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)furan-2-carboxamide
CID 106608715

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine?
The IUPAC name of 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine (CID 83907601) is 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine.
What is the SMILES notation for 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine?
The canonical SMILES for 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine is Cc1ccc(C(C)CC2CCCN2)o1.
What is the InChIKey of 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine?
The InChIKey is MPTZXOOETNTARY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-9(8-11-4-3-7-13-11)12-6-5-10(2)14-12/h5-6,9,11,13H,3-4,7-8H2,1-2H3.
What are the key properties of 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine?
2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine has a molecular weight of 193.29 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine is sourced from PubChem (CID 83907601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).