2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine

C17H34N2O — CID 107392083

IUPAC2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine
SMILESCCCNC1CCCC1CCN1CCCC(C)(OC)C1
InChIInChI=1S/C17H34N2O/c1-4-11-18-16-8-5-7-15(16)9-13-19-12-6-10-17(2,14-19)20-3/h15-16,18H,4-14H2,1-3H3
InChIKeyUAKPQLGMKJMSCS-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.05
Rot. Bonds7

About 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine

2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine (PubChem CID 107392083) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine
PubChem CID107392083
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine
SMILESCCCNC1CCCC1CCN1CCCC(C)(OC)C1
InChIInChI=1S/C17H34N2O/c1-4-11-18-16-8-5-7-15(16)9-13-19-12-6-10-17(2,14-19)20-3/h15-16,18H,4-14H2,1-3H3
InChIKeyUAKPQLGMKJMSCS-UHFFFAOYSA-N
XLogP3.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylbutyl)-N-(3-morpholin-4-ylpropyl)cyclopentan-1-amine
CID 86779410
N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-1-methoxypropan-2-amine
CID 50971002
3-(2,3-Diethylmorpholin-2-yl)propan-1-amine
CID 174690259
[2-(2,2-Dimethylmorpholin-4-yl)cyclopentyl]methanamine
CID 43592477
[2-(3-Propoxypiperidin-1-yl)cyclopentyl]methanamine
CID 54985233
2-[(2,2-dimethylmorpholin-4-yl)methyl]-N-ethylcyclopentan-1-amine
CID 55093796
2-[(3-ethylmorpholin-4-yl)methyl]-N-propylcyclopentan-1-amine
CID 55093845
N-propyl-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]cyclopentan-1-amine
CID 55094470
N-methyl-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]cyclopentan-1-amine
CID 55094471
N-ethyl-2-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cyclopentan-1-amine
CID 55094473
1-[2-(3-Methylbutoxy)ethyl]-4-pyrrolidin-2-ylpiperidine
CID 55168973
[2-(3-Ethoxypiperidin-1-yl)cyclopentyl]methanamine
CID 61570528

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine?
The IUPAC name of 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine (CID 107392083) is 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine.
What is the SMILES notation for 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine?
The canonical SMILES for 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine is CCCNC1CCCC1CCN1CCCC(C)(OC)C1.
What is the InChIKey of 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine?
The InChIKey is UAKPQLGMKJMSCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-4-11-18-16-8-5-7-15(16)9-13-19-12-6-10-17(2,14-19)20-3/h15-16,18H,4-14H2,1-3H3.
What are the key properties of 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine?
2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine has a molecular weight of 282.47 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]-N-propylcyclopentan-1-amine is sourced from PubChem (CID 107392083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).