N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine

C15H24N2O — CID 28647420

IUPACN-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine
SMILESc1coc([C@H](CNC2CCCC2)N2CCCC2)c1
InChIInChI=1S/C15H24N2O/c1-2-7-13(6-1)16-12-14(15-8-5-11-18-15)17-9-3-4-10-17/h5,8,11,13-14,16H,1-4,6-7,9-10,12H2/t14-/m0/s1
InChIKeyBOHZWCLFBRDDIO-AWEZNQCLSA-N
MW248.37 g/mol
LogP2.95
Rot. Bonds5

About N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine

N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine (PubChem CID 28647420) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine
PubChem CID28647420
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine
SMILESc1coc([C@H](CNC2CCCC2)N2CCCC2)c1
InChIInChI=1S/C15H24N2O/c1-2-7-13(6-1)16-12-14(15-8-5-11-18-15)17-9-3-4-10-17/h5,8,11,13-14,16H,1-4,6-7,9-10,12H2/t14-/m0/s1
InChIKeyBOHZWCLFBRDDIO-AWEZNQCLSA-N
XLogP2.95
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine?
The IUPAC name of N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine (CID 28647420) is N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine.
What is the SMILES notation for N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine?
The canonical SMILES for N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine is c1coc([C@H](CNC2CCCC2)N2CCCC2)c1.
What is the InChIKey of N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine?
The InChIKey is BOHZWCLFBRDDIO-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-7-13(6-1)16-12-14(15-8-5-11-18-15)17-9-3-4-10-17/h5,8,11,13-14,16H,1-4,6-7,9-10,12H2/t14-/m0/s1.
What are the key properties of N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine?
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine has a molecular weight of 248.37 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentanamine is sourced from PubChem (CID 28647420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).