N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine

C14H28N2 — CID 79863443

IUPACN,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine
SMILESCN(CC1CCNCC1)C1CCCC1(C)C
InChIInChI=1S/C14H28N2/c1-14(2)8-4-5-13(14)16(3)11-12-6-9-15-10-7-12/h12-13,15H,4-11H2,1-3H3
InChIKeyTWKNKSFTIQIBFJ-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.50
Rot. Bonds3

About N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine

N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine (PubChem CID 79863443) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine
PubChem CID79863443
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine
SMILESCN(CC1CCNCC1)C1CCCC1(C)C
InChIInChI=1S/C14H28N2/c1-14(2)8-4-5-13(14)16(3)11-12-6-9-15-10-7-12/h12-13,15H,4-11H2,1-3H3
InChIKeyTWKNKSFTIQIBFJ-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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 N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine?
The IUPAC name of N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine (CID 79863443) is N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine is CN(CC1CCNCC1)C1CCCC1(C)C.
What is the InChIKey of N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine?
The InChIKey is TWKNKSFTIQIBFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-14(2)8-4-5-13(14)16(3)11-12-6-9-15-10-7-12/h12-13,15H,4-11H2,1-3H3.
What are the key properties of N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine?
N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 79863443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).