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

C14H28N2 — CID 62609502

IUPAC2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine
SMILESCCC1CCN(CC2CCCC2NC)CC1
InChIInChI=1S/C14H28N2/c1-3-12-7-9-16(10-8-12)11-13-5-4-6-14(13)15-2/h12-15H,3-11H2,1-2H3
InChIKeyWCSCDYXWOVMGHN-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.50
Rot. Bonds4

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

2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine (PubChem CID 62609502) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine
PubChem CID62609502
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine
SMILESCCC1CCN(CC2CCCC2NC)CC1
InChIInChI=1S/C14H28N2/c1-3-12-7-9-16(10-8-12)11-13-5-4-6-14(13)15-2/h12-15H,3-11H2,1-2H3
InChIKeyWCSCDYXWOVMGHN-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine?
The IUPAC name of 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine (CID 62609502) is 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine.
What is the SMILES notation for 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine?
The canonical SMILES for 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine is CCC1CCN(CC2CCCC2NC)CC1.
What is the InChIKey of 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine?
The InChIKey is WCSCDYXWOVMGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-12-7-9-16(10-8-12)11-13-5-4-6-14(13)15-2/h12-15H,3-11H2,1-2H3.
What are the key properties of 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine?
2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine is sourced from PubChem (CID 62609502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).