N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine

C15H24N2 — CID 63155191

IUPACN-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine
SMILESCCN(C)CC1(c2ccccc2)CCNCC1
InChIInChI=1S/C15H24N2/c1-3-17(2)13-15(9-11-16-12-10-15)14-7-5-4-6-8-14/h4-8,16H,3,9-13H2,1-2H3
InChIKeyLDRCWOOXILLUAC-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.26
Rot. Bonds4

About N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine

N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine (PubChem CID 63155191) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine
PubChem CID63155191
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine
SMILESCCN(C)CC1(c2ccccc2)CCNCC1
InChIInChI=1S/C15H24N2/c1-3-17(2)13-15(9-11-16-12-10-15)14-7-5-4-6-8-14/h4-8,16H,3,9-13H2,1-2H3
InChIKeyLDRCWOOXILLUAC-UHFFFAOYSA-N
XLogP2.26
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine?
The IUPAC name of N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine (CID 63155191) is N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine.
What is the SMILES notation for N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine?
The canonical SMILES for N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine is CCN(C)CC1(c2ccccc2)CCNCC1.
What is the InChIKey of N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine?
The InChIKey is LDRCWOOXILLUAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-17(2)13-15(9-11-16-12-10-15)14-7-5-4-6-8-14/h4-8,16H,3,9-13H2,1-2H3.
What are the key properties of N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine?
N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine has a molecular weight of 232.37 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]ethanamine is sourced from PubChem (CID 63155191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).