1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine

C15H31N3 — CID 54967617

IUPAC1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine
SMILESCC1CN(C)C(C)CC1NCCN1CCCCC1
InChIInChI=1S/C15H31N3/c1-13-12-17(3)14(2)11-15(13)16-7-10-18-8-5-4-6-9-18/h13-16H,4-12H2,1-3H3
InChIKeySPVPQPWVXZJEOT-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.79
Rot. Bonds4

About 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine

1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine (PubChem CID 54967617) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine.

Molecular Properties

Compound Name1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine
PubChem CID54967617
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine
SMILESCC1CN(C)C(C)CC1NCCN1CCCCC1
InChIInChI=1S/C15H31N3/c1-13-12-17(3)14(2)11-15(13)16-7-10-18-8-5-4-6-9-18/h13-16H,4-12H2,1-3H3
InChIKeySPVPQPWVXZJEOT-UHFFFAOYSA-N
XLogP1.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,2,5-trimethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-4-amine
CID 54860823
1,2,5-trimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]piperidin-4-amine
CID 43665481
2-[[(2R,4S,5R)-1,2,5-trimethylpiperidin-4-yl]amino]ethanol
CID 93258534
(2R,4S,5S)-1,2,5-trimethyl-N-pentylpiperidin-4-amine
CID 93258445
N'-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 60890113
trans-(1R,2R)-2-methyl-N-(2-piperidin-1-ylethyl)cyclopentan-1-amine
CID 96923223
N',N'-dimethyl-N-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 5149120
N'-cyclohexyl-N'-methyl-N-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 60981234
N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine
CID 115728653
(2R,4S,5R)-N-cyclopentyl-1,2,5-trimethylpiperidin-4-amine
CID 93258430
(2S)-1-[(1,2,5-trimethylpiperidin-4-yl)amino]propan-2-ol
CID 103906573
(2S)-1-[[(2R,4R,5S)-1,2,5-trimethylpiperidin-4-yl]amino]propan-2-ol
CID 124526610

Frequently Asked Questions

What is the IUPAC name of 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine?
The IUPAC name of 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine (CID 54967617) is 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine.
What is the SMILES notation for 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine?
The canonical SMILES for 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine is CC1CN(C)C(C)CC1NCCN1CCCCC1.
What is the InChIKey of 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine?
The InChIKey is SPVPQPWVXZJEOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-13-12-17(3)14(2)11-15(13)16-7-10-18-8-5-4-6-9-18/h13-16H,4-12H2,1-3H3.
What are the key properties of 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine?
1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine has a molecular weight of 253.43 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine is sourced from PubChem (CID 54967617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).