2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine

C17H35N3 — CID 79407138

IUPAC2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CC2CCCCN2C)C(C)C1C
InChIInChI=1S/C17H35N3/c1-5-10-18-17-9-12-20(15(3)14(17)2)13-16-8-6-7-11-19(16)4/h14-18H,5-13H2,1-4H3
InChIKeyYPINGYPKUBHRKZ-UHFFFAOYSA-N
MW281.49 g/mol
LogP2.57
Rot. Bonds5

About 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine

2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine (PubChem CID 79407138) has the molecular formula C17H35N3 and a molecular weight of 281.49 g/mol. Its IUPAC name is 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine
PubChem CID79407138
Molecular FormulaC17H35N3
Molecular Weight281.49 g/mol
Exact Mass281.28
IUPAC Name2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CC2CCCCN2C)C(C)C1C
InChIInChI=1S/C17H35N3/c1-5-10-18-17-9-12-20(15(3)14(17)2)13-16-8-6-7-11-19(16)4/h14-18H,5-13H2,1-4H3
InChIKeyYPINGYPKUBHRKZ-UHFFFAOYSA-N
XLogP2.57
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.49
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-ethylcyclohexyl)methyl]-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79413433
1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397144
2,3-dimethyl-N-propyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 79406592
1-[4-(dimethylamino)butyl]-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79406875
2,3-dimethyl-N-propyl-1-(2-thiomorpholin-4-ylethyl)piperidin-4-amine
CID 106325781
2,3-dimethyl-1-(2-methylsulfanylpropyl)-N-propylpiperidin-4-amine
CID 113466578
2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine
CID 79398266
2,3-dimethyl-1-(2-prop-2-enylsulfanylethyl)-N-propylpiperidin-4-amine
CID 106429737
1-[(2-ethylphenyl)methyl]-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79413586
2,3-dimethyl-1-(2-methylbutan-2-yl)-N-propylpiperidin-4-amine
CID 79398269
1-N-methyl-1-N-[(1-methylpyrrolidin-2-yl)methyl]-2-N-propylcycloheptane-1,2-diamine
CID 79313962
(2R)-2-ethyl-1-methylpiperidine
CID 67552955

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine?
The IUPAC name of 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine (CID 79407138) is 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine.
What is the SMILES notation for 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine?
The canonical SMILES for 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine is CCCNC1CCN(CC2CCCCN2C)C(C)C1C.
What is the InChIKey of 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine?
The InChIKey is YPINGYPKUBHRKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3/c1-5-10-18-17-9-12-20(15(3)14(17)2)13-16-8-6-7-11-19(16)4/h14-18H,5-13H2,1-4H3.
What are the key properties of 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine?
2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine has a molecular weight of 281.49 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine is sourced from PubChem (CID 79407138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).