3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine

C22H30N2 — CID 10805809

IUPAC3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine
SMILESCC1CN(CCc2ccccc2)CC(C)(C)C1Nc1ccccc1
InChIInChI=1S/C22H30N2/c1-18-16-24(15-14-19-10-6-4-7-11-19)17-22(2,3)21(18)23-20-12-8-5-9-13-20/h4-13,18,21,23H,14-17H2,1-3H3
InChIKeyYTSQGYDQSNUMAK-UHFFFAOYSA-N
MW322.50 g/mol
LogP4.69
Rot. Bonds5

About 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine

3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine (PubChem CID 10805809) has the molecular formula C22H30N2 and a molecular weight of 322.50 g/mol. Its IUPAC name is 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine.

Molecular Properties

Compound Name3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine
PubChem CID10805809
Molecular FormulaC22H30N2
Molecular Weight322.50 g/mol
Exact Mass322.24
IUPAC Name3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine
SMILESCC1CN(CCc2ccccc2)CC(C)(C)C1Nc1ccccc1
InChIInChI=1S/C22H30N2/c1-18-16-24(15-14-19-10-6-4-7-11-19)17-22(2,3)21(18)23-20-12-8-5-9-13-20/h4-13,18,21,23H,14-17H2,1-3H3
InChIKeyYTSQGYDQSNUMAK-UHFFFAOYSA-N
XLogP4.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.50
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[6,6-dimethyl-4-(2-phenylethyl)morpholin-2-yl]methanol
CID 114779799
3,3-dimethyl-1-(2-phenylethyl)piperidine-4-carbonitrile
CID 117024510
1,8,8-trimethyl-3-(2-phenylethyl)-3-azabicyclo[3.2.1]octane;hydrochloride
CID 24833947
N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine
CID 106318668
(3aS,6aR)-2-methyl-5-(2-phenylethyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 118534999
[(3R)-4-anilino-1-(2-phenylethyl)piperidin-3-yl]methanol
CID 166659178
N-(2,2-dimethylcyclopropyl)aniline
CID 122457066
1-[4-[(3S,4R)-4-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]piperazin-1-yl]ethanone
CID 129462097
N-(3-methylphenyl)-1-(2-phenylethyl)pyrrolidin-3-amine
CID 61211943
(3S)-3-methyl-1-(2-phenylethyl)piperazine
CID 95243884
3-methyl-1-(2-phenylethyl)-3,6-dihydro-2H-pyridine
CID 167582068
N-(4-nitrophenyl)-1-(2-phenylethyl)piperidin-4-amine
CID 12741863

Frequently Asked Questions

What is the IUPAC name of 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine?
The IUPAC name of 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine (CID 10805809) is 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine.
What is the SMILES notation for 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine?
The canonical SMILES for 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine is CC1CN(CCc2ccccc2)CC(C)(C)C1Nc1ccccc1.
What is the InChIKey of 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine?
The InChIKey is YTSQGYDQSNUMAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2/c1-18-16-24(15-14-19-10-6-4-7-11-19)17-22(2,3)21(18)23-20-12-8-5-9-13-20/h4-13,18,21,23H,14-17H2,1-3H3.
What are the key properties of 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine?
3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine has a molecular weight of 322.50 g/mol, XLogP of 4.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5-trimethyl-N-phenyl-1-(2-phenylethyl)piperidin-4-amine is sourced from PubChem (CID 10805809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).