1-benzyl-6-methylpiperidin-3-amine

C13H20N2 — CID 54593768

IUPAC1-benzyl-6-methylpiperidin-3-amine
SMILESCC1CCC(N)CN1Cc1ccccc1
InChIInChI=1S/C13H20N2/c1-11-7-8-13(14)10-15(11)9-12-5-3-2-4-6-12/h2-6,11,13H,7-10,14H2,1H3
InChIKeyJKSBJAIJUUQUJS-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.00
Rot. Bonds2

About 1-benzyl-6-methylpiperidin-3-amine

1-benzyl-6-methylpiperidin-3-amine (PubChem CID 54593768) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-benzyl-6-methylpiperidin-3-amine.

Molecular Properties

Compound Name1-benzyl-6-methylpiperidin-3-amine
PubChem CID54593768
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name1-benzyl-6-methylpiperidin-3-amine
SMILESCC1CCC(N)CN1Cc1ccccc1
InChIInChI=1S/C13H20N2/c1-11-7-8-13(14)10-15(11)9-12-5-3-2-4-6-12/h2-6,11,13H,7-10,14H2,1H3
InChIKeyJKSBJAIJUUQUJS-UHFFFAOYSA-N
XLogP2.00
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-2,5-dimethylpiperidine
CID 73200484
6-methyl-1-(3-phenylpropyl)piperidin-3-amine
CID 61238461
(1-benzyl-6-methylpiperidin-3-yl)methanol
CID 22106848
(4S)-1-benzyl-2,4-dimethylpyrrolidine
CID 118651465
(2S,4R)-1-benzyl-2,4-dimethylpyrrolidine
CID 15316822
1-benzyl-6-methylpiperidine-3,4-diol
CID 6421584
1-benzyl-2,4,5-trimethylpiperazine
CID 72621990
(2S,4S)-1-benzyl-4-chloro-2-methylpyrrolidine
CID 101162371
(2R,4S)-1-benzyl-4-chloro-2-methylpyrrolidine
CID 131036325
(2S,5R)-1-benzyl-2,5-dimethylpiperazine
CID 23402345
4,11-dibenzyl-1,5,8,12-tetramethyl-1,4,8,11-tetrazacyclotetradecane
CID 101436229
1-benzyl-2,4-dimethylpiperazine;ethane
CID 145145723

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-6-methylpiperidin-3-amine?
The IUPAC name of 1-benzyl-6-methylpiperidin-3-amine (CID 54593768) is 1-benzyl-6-methylpiperidin-3-amine.
What is the SMILES notation for 1-benzyl-6-methylpiperidin-3-amine?
The canonical SMILES for 1-benzyl-6-methylpiperidin-3-amine is CC1CCC(N)CN1Cc1ccccc1.
What is the InChIKey of 1-benzyl-6-methylpiperidin-3-amine?
The InChIKey is JKSBJAIJUUQUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-11-7-8-13(14)10-15(11)9-12-5-3-2-4-6-12/h2-6,11,13H,7-10,14H2,1H3.
What are the key properties of 1-benzyl-6-methylpiperidin-3-amine?
1-benzyl-6-methylpiperidin-3-amine has a molecular weight of 204.32 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-6-methylpiperidin-3-amine is sourced from PubChem (CID 54593768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).