1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine

C16H30N2O — CID 62435322

IUPAC1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine
SMILESCNCC1CCC(CN2CCCC2C2CCCC2)O1
InChIInChI=1S/C16H30N2O/c1-17-11-14-8-9-15(19-14)12-18-10-4-7-16(18)13-5-2-3-6-13/h13-17H,2-12H2,1H3
InChIKeyDNCVMDNBJBTHCN-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.41
Rot. Bonds5

About 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine

1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine (PubChem CID 62435322) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine
PubChem CID62435322
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine
SMILESCNCC1CCC(CN2CCCC2C2CCCC2)O1
InChIInChI=1S/C16H30N2O/c1-17-11-14-8-9-15(19-14)12-18-10-4-7-16(18)13-5-2-3-6-13/h13-17H,2-12H2,1H3
InChIKeyDNCVMDNBJBTHCN-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine (CID 62435322) is 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine is CNCC1CCC(CN2CCCC2C2CCCC2)O1.
What is the InChIKey of 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine?
The InChIKey is DNCVMDNBJBTHCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-17-11-14-8-9-15(19-14)12-18-10-4-7-16(18)13-5-2-3-6-13/h13-17H,2-12H2,1H3.
What are the key properties of 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine?
1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine has a molecular weight of 266.43 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine is sourced from PubChem (CID 62435322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).