N,1-dibenzyl-5-methylpiperidin-3-amine

C20H26N2 — CID 83993568

IUPACN,1-dibenzyl-5-methylpiperidin-3-amine
SMILESCC1CC(NCc2ccccc2)CN(Cc2ccccc2)C1
InChIInChI=1S/C20H26N2/c1-17-12-20(21-13-18-8-4-2-5-9-18)16-22(14-17)15-19-10-6-3-7-11-19/h2-11,17,20-21H,12-16H2,1H3
InChIKeyDECRXBVRHZMYRF-UHFFFAOYSA-N
MW294.44 g/mol
LogP3.69
Rot. Bonds5

About N,1-dibenzyl-5-methylpiperidin-3-amine

N,1-dibenzyl-5-methylpiperidin-3-amine (PubChem CID 83993568) has the molecular formula C20H26N2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N,1-dibenzyl-5-methylpiperidin-3-amine.

Molecular Properties

Compound NameN,1-dibenzyl-5-methylpiperidin-3-amine
PubChem CID83993568
Molecular FormulaC20H26N2
Molecular Weight294.44 g/mol
Exact Mass294.21
IUPAC NameN,1-dibenzyl-5-methylpiperidin-3-amine
SMILESCC1CC(NCc2ccccc2)CN(Cc2ccccc2)C1
InChIInChI=1S/C20H26N2/c1-17-12-20(21-13-18-8-4-2-5-9-18)16-22(14-17)15-19-10-6-3-7-11-19/h2-11,17,20-21H,12-16H2,1H3
InChIKeyDECRXBVRHZMYRF-UHFFFAOYSA-N
XLogP3.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-1-[(4-fluorophenyl)methyl]-5-methylpiperidin-3-amine
CID 83993582
N-benzyl-1-butyl-5-methylpiperidin-3-amine
CID 112541370
1-benzyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
CID 83997025
1-benzyl-N-cyclohexyl-5-methylpiperidin-3-amine
CID 83999101
N-[[3-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]cyclopropanamine
CID 62423584
methyl 3-[3-(benzylamino)-5-methylpiperidin-1-yl]propanoate
CID 83993992
(2R)-2-[[(3S,5R)-1-benzyl-5-methylpiperidin-3-yl]amino]-N-methylpropanamide
CID 99639603
(1S,5S)-3-benzyl-3-azabicyclo[3.1.0]hexane
CID 98048046
1-[(4-fluorophenyl)methyl]-5-methyl-N-propylpiperidin-3-amine
CID 83990912
N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]-2-methylpropan-2-amine
CID 62424303
N-(2,2-dimethylpropyl)-1-[(3-fluorophenyl)methyl]-5-methylpiperidin-3-amine
CID 83994969
N,1-dibenzyl-2-methylpiperidin-4-amine
CID 119029011

Frequently Asked Questions

What is the IUPAC name of N,1-dibenzyl-5-methylpiperidin-3-amine?
The IUPAC name of N,1-dibenzyl-5-methylpiperidin-3-amine (CID 83993568) is N,1-dibenzyl-5-methylpiperidin-3-amine.
What is the SMILES notation for N,1-dibenzyl-5-methylpiperidin-3-amine?
The canonical SMILES for N,1-dibenzyl-5-methylpiperidin-3-amine is CC1CC(NCc2ccccc2)CN(Cc2ccccc2)C1.
What is the InChIKey of N,1-dibenzyl-5-methylpiperidin-3-amine?
The InChIKey is DECRXBVRHZMYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2/c1-17-12-20(21-13-18-8-4-2-5-9-18)16-22(14-17)15-19-10-6-3-7-11-19/h2-11,17,20-21H,12-16H2,1H3.
What are the key properties of N,1-dibenzyl-5-methylpiperidin-3-amine?
N,1-dibenzyl-5-methylpiperidin-3-amine has a molecular weight of 294.44 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dibenzyl-5-methylpiperidin-3-amine is sourced from PubChem (CID 83993568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).