1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine

C16H26N2O — CID 63256708

IUPAC1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine
SMILESCC(Cc1ccco1)N1CCCCC1C1CCCN1
InChIInChI=1S/C16H26N2O/c1-13(12-14-6-5-11-19-14)18-10-3-2-8-16(18)15-7-4-9-17-15/h5-6,11,13,15-17H,2-4,7-10,12H2,1H3
InChIKeyPCGXUSRXXLSWDW-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.82
Rot. Bonds4

About 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine

1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine (PubChem CID 63256708) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine.

Molecular Properties

Compound Name1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine
PubChem CID63256708
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine
SMILESCC(Cc1ccco1)N1CCCCC1C1CCCN1
InChIInChI=1S/C16H26N2O/c1-13(12-14-6-5-11-19-14)18-10-3-2-8-16(18)15-7-4-9-17-15/h5-6,11,13,15-17H,2-4,7-10,12H2,1H3
InChIKeyPCGXUSRXXLSWDW-UHFFFAOYSA-N
XLogP2.82
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpyrrolidine
CID 55180167
N-(furan-2-ylmethyl)-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)propanamide
CID 62274448
1-propan-2-yl-2-pyrrolidin-2-ylpiperidine
CID 63256346
1-[1-(furan-2-yl)propan-2-yl]azepane-2-carboxylic acid
CID 65069664
1-heptan-2-yl-2-pyrrolidin-2-ylpiperidine
CID 80557844
1-[1-(4-methoxyphenyl)propan-2-yl]-2-pyrrolidin-2-ylpyrrolidine
CID 63270961
4-(furan-2-ylmethyl)-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazine
CID 102571327
1-[1-(2-chlorophenyl)ethyl]-2-pyrrolidin-2-ylpiperidine
CID 63256309
3-cyclohexyl-1-[4-(furan-2-yl)butan-2-yl]piperazine
CID 64953713
N-ethyl-1-[1-(furan-2-yl)propan-2-yl]-2,3-dimethylpiperidin-4-amine
CID 79397893
1-[1-(5-chlorothiophen-2-yl)ethyl]-2-pyrrolidin-2-ylpiperidine
CID 63256751
1-heptan-4-yl-2-pyrrolidin-2-ylpyrrolidine
CID 62274223

Frequently Asked Questions

What is the IUPAC name of 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine?
The IUPAC name of 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine (CID 63256708) is 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine.
What is the SMILES notation for 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine?
The canonical SMILES for 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine is CC(Cc1ccco1)N1CCCCC1C1CCCN1.
What is the InChIKey of 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine?
The InChIKey is PCGXUSRXXLSWDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13(12-14-6-5-11-19-14)18-10-3-2-8-16(18)15-7-4-9-17-15/h5-6,11,13,15-17H,2-4,7-10,12H2,1H3.
What are the key properties of 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine?
1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine has a molecular weight of 262.40 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpiperidine is sourced from PubChem (CID 63256708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).