1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine

C15H31N3 — CID 82565050

IUPAC1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine
SMILESCCC1CCCCN1C1CNCCC1CN(C)C
InChIInChI=1S/C15H31N3/c1-4-14-7-5-6-10-18(14)15-11-16-9-8-13(15)12-17(2)3/h13-16H,4-12H2,1-3H3
InChIKeyCMTLKAZQOXHCEZ-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.79
Rot. Bonds4

About 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine

1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine (PubChem CID 82565050) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine
PubChem CID82565050
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine
SMILESCCC1CCCCN1C1CNCCC1CN(C)C
InChIInChI=1S/C15H31N3/c1-4-14-7-5-6-10-18(14)15-11-16-9-8-13(15)12-17(2)3/h13-16H,4-12H2,1-3H3
InChIKeyCMTLKAZQOXHCEZ-UHFFFAOYSA-N
XLogP1.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine (CID 82565050) is 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine is CCC1CCCCN1C1CNCCC1CN(C)C.
What is the InChIKey of 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine?
The InChIKey is CMTLKAZQOXHCEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-4-14-7-5-6-10-18(14)15-11-16-9-8-13(15)12-17(2)3/h13-16H,4-12H2,1-3H3.
What are the key properties of 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine?
1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine has a molecular weight of 253.43 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-ethylpiperidin-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 82565050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).