1-benzyl-N,N,3-trimethylpiperidin-4-amine

C15H24N2 — CID 71634856

IUPAC1-benzyl-N,N,3-trimethylpiperidin-4-amine
SMILESCC1CN(Cc2ccccc2)CCC1N(C)C
InChIInChI=1S/C15H24N2/c1-13-11-17(10-9-15(13)16(2)3)12-14-7-5-4-6-8-14/h4-8,13,15H,9-12H2,1-3H3
InChIKeyKAKCSWWQYPXOFQ-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.46
Rot. Bonds3

About 1-benzyl-N,N,3-trimethylpiperidin-4-amine

1-benzyl-N,N,3-trimethylpiperidin-4-amine (PubChem CID 71634856) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-benzyl-N,N,3-trimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-benzyl-N,N,3-trimethylpiperidin-4-amine
PubChem CID71634856
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-benzyl-N,N,3-trimethylpiperidin-4-amine
SMILESCC1CN(Cc2ccccc2)CCC1N(C)C
InChIInChI=1S/C15H24N2/c1-13-11-17(10-9-15(13)16(2)3)12-14-7-5-4-6-8-14/h4-8,13,15H,9-12H2,1-3H3
InChIKeyKAKCSWWQYPXOFQ-UHFFFAOYSA-N
XLogP2.46
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4S)-1-benzyl-N-[2-(1,3-dioxolan-2-yl)ethyl]-N,3-dimethylpiperidin-4-amine
CID 99606871
(3S,4S)-1-benzyl-4-chloro-3-methylpiperidine
CID 97176910
N-[(3R,4S)-1-benzyl-3-methylpiperidin-4-yl]-N-methyl-2-(methylamino)acetamide
CID 125145982
(3S,4S)-1-benzyl-3-methylpiperidin-4-amine
CID 34178997
N-[(3S,4S)-1-benzyl-3-methylpiperidin-4-yl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine
CID 95632240
N-[(3R,4R)-1-benzyl-3-methylpiperidin-4-yl]-2-ethoxy-N-methylacetamide
CID 124730164
(3R,4S)-1-benzyl-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidin-4-amine
CID 96560100
1-(1-benzyl-3-methylpiperidin-4-yl)-1-methyl-3-prop-2-ynylurea
CID 71848262
1-[(3R,4S)-1-benzyl-3-methylpiperidin-4-yl]-1-methyl-3-prop-2-ynylurea
CID 96542989
1-[(1-benzyl-3-methylpiperidin-4-yl)-methylamino]-3-propan-2-yloxypropan-2-ol
CID 111858533
(1-benzyl-3-methylpiperidin-4-yl)methanol
CID 130927897
N-[(3R,4S)-1-benzyl-3-methylpiperidin-4-yl]-N,4-dimethylthiadiazole-5-carboxamide
CID 100624175

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N,N,3-trimethylpiperidin-4-amine?
The IUPAC name of 1-benzyl-N,N,3-trimethylpiperidin-4-amine (CID 71634856) is 1-benzyl-N,N,3-trimethylpiperidin-4-amine.
What is the SMILES notation for 1-benzyl-N,N,3-trimethylpiperidin-4-amine?
The canonical SMILES for 1-benzyl-N,N,3-trimethylpiperidin-4-amine is CC1CN(Cc2ccccc2)CCC1N(C)C.
What is the InChIKey of 1-benzyl-N,N,3-trimethylpiperidin-4-amine?
The InChIKey is KAKCSWWQYPXOFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-13-11-17(10-9-15(13)16(2)3)12-14-7-5-4-6-8-14/h4-8,13,15H,9-12H2,1-3H3.
What are the key properties of 1-benzyl-N,N,3-trimethylpiperidin-4-amine?
1-benzyl-N,N,3-trimethylpiperidin-4-amine has a molecular weight of 232.37 g/mol, XLogP of 2.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N,N,3-trimethylpiperidin-4-amine is sourced from PubChem (CID 71634856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).