1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine

C16H26N2 — CID 62489691

IUPAC1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine
SMILESCC1CCCC(C)N1CC(C)(N)c1ccccc1
InChIInChI=1S/C16H26N2/c1-13-8-7-9-14(2)18(13)12-16(3,17)15-10-5-4-6-11-15/h4-6,10-11,13-14H,7-9,12,17H2,1-3H3
InChIKeyRUDJVRMLUQFNPQ-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.12
Rot. Bonds3

About 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine

1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine (PubChem CID 62489691) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine.

Molecular Properties

Compound Name1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine
PubChem CID62489691
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine
SMILESCC1CCCC(C)N1CC(C)(N)c1ccccc1
InChIInChI=1S/C16H26N2/c1-13-8-7-9-14(2)18(13)12-16(3,17)15-10-5-4-6-11-15/h4-6,10-11,13-14H,7-9,12,17H2,1-3H3
InChIKeyRUDJVRMLUQFNPQ-UHFFFAOYSA-N
XLogP3.12
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 6468
Cinnarizine
CID 1547484
Cyclizine
CID 6726
Phencyclidine Hydrochloride
CID 9795678
1-Benzylpiperazine
CID 75994
Cyclizine Hydrochloride
CID 6420019
N-ethyl-1-phenylcyclohexanamine
CID 16622
1-(Bis(4-fluorophenyl)methyl)piperazine
CID 152932
Benzhydrylpiperazine
CID 70048
2-Benzylpiperidine
CID 118004
(E)-1-Benzhydryl-4-cinnamylpiperazine
CID 1615336
1-Benzyl-4-methyl-piperazine
CID 763557

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine?
The IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine (CID 62489691) is 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine.
What is the SMILES notation for 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine?
The canonical SMILES for 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine is CC1CCCC(C)N1CC(C)(N)c1ccccc1.
What is the InChIKey of 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine?
The InChIKey is RUDJVRMLUQFNPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-13-8-7-9-14(2)18(13)12-16(3,17)15-10-5-4-6-11-15/h4-6,10-11,13-14H,7-9,12,17H2,1-3H3.
What are the key properties of 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine?
1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine has a molecular weight of 246.40 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine is sourced from PubChem (CID 62489691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).