2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine

C14H28N2O — CID 82767301

IUPAC2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine
SMILESCCOC1CCN(CC2(C)CCCC2N)CC1
InChIInChI=1S/C14H28N2O/c1-3-17-12-6-9-16(10-7-12)11-14(2)8-4-5-13(14)15/h12-13H,3-11,15H2,1-2H3
InChIKeyMXTSMKWAVUXYDA-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.00
Rot. Bonds4

About 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine

2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine (PubChem CID 82767301) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine
PubChem CID82767301
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine
SMILESCCOC1CCN(CC2(C)CCCC2N)CC1
InChIInChI=1S/C14H28N2O/c1-3-17-12-6-9-16(10-7-12)11-14(2)8-4-5-13(14)15/h12-13H,3-11,15H2,1-2H3
InChIKeyMXTSMKWAVUXYDA-UHFFFAOYSA-N
XLogP2.00
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine?
The IUPAC name of 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine (CID 82767301) is 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine is CCOC1CCN(CC2(C)CCCC2N)CC1.
What is the InChIKey of 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine?
The InChIKey is MXTSMKWAVUXYDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-17-12-6-9-16(10-7-12)11-14(2)8-4-5-13(14)15/h12-13H,3-11,15H2,1-2H3.
What are the key properties of 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine?
2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine has a molecular weight of 240.39 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 82767301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).