2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine

C18H30N2 — CID 79398266

IUPAC2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CCc2ccccc2)C(C)C1C
InChIInChI=1S/C18H30N2/c1-4-12-19-18-11-14-20(16(3)15(18)2)13-10-17-8-6-5-7-9-17/h5-9,15-16,18-19H,4,10-14H2,1-3H3
InChIKeyUYALVRFMOOJAPU-UHFFFAOYSA-N
MW274.45 g/mol
LogP3.33
Rot. Bonds6

About 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine

2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine (PubChem CID 79398266) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine
PubChem CID79398266
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CCc2ccccc2)C(C)C1C
InChIInChI=1S/C18H30N2/c1-4-12-19-18-11-14-20(16(3)15(18)2)13-10-17-8-6-5-7-9-17/h5-9,15-16,18-19H,4,10-14H2,1-3H3
InChIKeyUYALVRFMOOJAPU-UHFFFAOYSA-N
XLogP3.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-ethylphenyl)methyl]-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79413586
N-ethyl-1-[2-(3-methoxyphenyl)ethyl]-2,3-dimethylpiperidin-4-amine
CID 107852933
2,3-dimethyl-N-propyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 79406592
1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397144
2,3-dimethyl-1-[(6-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
CID 79406728
1-(2-ethylphenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397422
1-(2-fluorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397280
1-(2-chlorophenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397876
2,3-dimethyl-1-(2-prop-2-enylsulfanylethyl)-N-propylpiperidin-4-amine
CID 106429737
[(2R,3R,4S)-2,3-dimethyl-1-(2-phenylethyl)piperidin-4-yl] acetate
CID 715185
2,3-dimethyl-1-(4-methylphenyl)-N-propylpiperidin-4-amine
CID 79397861
2,3-dimethyl-1-(3-phenylpropyl)piperidin-4-amine
CID 79397057

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine?
The IUPAC name of 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine (CID 79398266) is 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine.
What is the SMILES notation for 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine?
The canonical SMILES for 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine is CCCNC1CCN(CCc2ccccc2)C(C)C1C.
What is the InChIKey of 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine?
The InChIKey is UYALVRFMOOJAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-4-12-19-18-11-14-20(16(3)15(18)2)13-10-17-8-6-5-7-9-17/h5-9,15-16,18-19H,4,10-14H2,1-3H3.
What are the key properties of 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine?
2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine has a molecular weight of 274.45 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine is sourced from PubChem (CID 79398266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).