1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine

C16H26N2 — CID 83982317

IUPAC1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine
SMILESCNC(C)CC1CCCCN1Cc1ccccc1
InChIInChI=1S/C16H26N2/c1-14(17-2)12-16-10-6-7-11-18(16)13-15-8-4-3-5-9-15/h3-5,8-9,14,16-17H,6-7,10-13H2,1-2H3
InChIKeyUPPUGXMCKDHYNO-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.04
Rot. Bonds5

About 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine

1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine (PubChem CID 83982317) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine
PubChem CID83982317
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine
SMILESCNC(C)CC1CCCCN1Cc1ccccc1
InChIInChI=1S/C16H26N2/c1-14(17-2)12-16-10-6-7-11-18(16)13-15-8-4-3-5-9-15/h3-5,8-9,14,16-17H,6-7,10-13H2,1-2H3
InChIKeyUPPUGXMCKDHYNO-UHFFFAOYSA-N
XLogP3.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-benzylpiperidin-2-yl)-2-methylpropan-1-ol
CID 83982303
4-(1-benzylpiperidin-2-yl)butan-2-ol
CID 83982325
3-[(2R)-1-benzylpiperidin-2-yl]-N-methylpropan-1-amine
CID 97167936
4-(1-benzylpiperidin-2-yl)butan-2-amine
CID 83982307
(2S)-1-benzyl-2-propylpiperidine
CID 71407726
4-[[2-(2-hydroxypropyl)piperidin-1-yl]methyl]benzoic acid
CID 114337900
(2S)-1-benzyl-2-[(2S)-2-phenylmethoxybutyl]piperidine
CID 122225055
(1-benzylpiperidin-2-yl)methylhydrazine
CID 53402111
1-[1-(2-phenylethyl)azepan-2-yl]propan-2-ol
CID 114338750
(2R)-1-benzyl-2-(bromomethyl)piperidine;hydrochloride
CID 67264853
1-benzyl-2-(2-chloroethyl)piperidine
CID 18473722
(1R)-2-[(2S)-1-benzylpiperidin-2-yl]-1-(4-fluorophenyl)ethanol
CID 125487473

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine?
The IUPAC name of 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine (CID 83982317) is 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine is CNC(C)CC1CCCCN1Cc1ccccc1.
What is the InChIKey of 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine?
The InChIKey is UPPUGXMCKDHYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-14(17-2)12-16-10-6-7-11-18(16)13-15-8-4-3-5-9-15/h3-5,8-9,14,16-17H,6-7,10-13H2,1-2H3.
What are the key properties of 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine?
1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine has a molecular weight of 246.40 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzylpiperidin-2-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 83982317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).