4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine

C15H28N2O — CID 66263076

IUPAC4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine
SMILESCC1(CN2CCCC2C2CCCC2)COCC1N
InChIInChI=1S/C15H28N2O/c1-15(11-18-9-14(15)16)10-17-8-4-7-13(17)12-5-2-3-6-12/h12-14H,2-11,16H2,1H3
InChIKeyMDXDOKSLMANJOV-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.00
Rot. Bonds3

About 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine

4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine (PubChem CID 66263076) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine.

Molecular Properties

Compound Name4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine
PubChem CID66263076
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine
SMILESCC1(CN2CCCC2C2CCCC2)COCC1N
InChIInChI=1S/C15H28N2O/c1-15(11-18-9-14(15)16)10-17-8-4-7-13(17)12-5-2-3-6-12/h12-14H,2-11,16H2,1H3
InChIKeyMDXDOKSLMANJOV-UHFFFAOYSA-N
XLogP2.00
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclohexyl-1-[2-(3-methyloxetan-3-yl)ethyl]pyrrolidine
CID 167914484
N-[[3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)oxolan-3-yl]methyl]ethanamine
CID 62258423
4-methyl-4-[(3-methylthiomorpholin-4-yl)methyl]oxolan-3-amine
CID 66262801
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-(4-amino-3-methyloxolan-3-yl)methanone
CID 66250603
1-[(2-cyclopentylpyrrolidin-1-yl)methyl]cyclopropan-1-amine
CID 65459564
1-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)cyclopropan-1-amine
CID 65459333
N-[[4-[(2-cyclopentylpyrrolidin-1-yl)methyl]oxan-4-yl]methyl]ethanamine
CID 62391325
4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-2,3,3-trimethylcyclohexan-1-amine
CID 102627661
[1-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)cyclopropyl]methanamine
CID 115453680
2-cyclopentyl-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine;hydrochloride
CID 120899104
4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-2,2,5,5-tetramethyloxolan-3-amine
CID 79912449
1-[3-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]methyl]oxolan-3-yl]-N-methylmethanamine
CID 102728271

Frequently Asked Questions

What is the IUPAC name of 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine?
The IUPAC name of 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine (CID 66263076) is 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine.
What is the SMILES notation for 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine?
The canonical SMILES for 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine is CC1(CN2CCCC2C2CCCC2)COCC1N.
What is the InChIKey of 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine?
The InChIKey is MDXDOKSLMANJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-15(11-18-9-14(15)16)10-17-8-4-7-13(17)12-5-2-3-6-12/h12-14H,2-11,16H2,1H3.
What are the key properties of 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine?
4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine has a molecular weight of 252.40 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-cyclopentylpyrrolidin-1-yl)methyl]-4-methyloxolan-3-amine is sourced from PubChem (CID 66263076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).