2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine

C15H31N3 — CID 115145605

IUPAC2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine
SMILESCN1CCCC(CCNC2CCNC(C)(C)C2)C1
InChIInChI=1S/C15H31N3/c1-15(2)11-14(7-9-17-15)16-8-6-13-5-4-10-18(3)12-13/h13-14,16-17H,4-12H2,1-3H3
InChIKeyAUZGGWPOFXCXDI-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.84
Rot. Bonds4

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

2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine (PubChem CID 115145605) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine
PubChem CID115145605
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine
SMILESCN1CCCC(CCNC2CCNC(C)(C)C2)C1
InChIInChI=1S/C15H31N3/c1-15(2)11-14(7-9-17-15)16-8-6-13-5-4-10-18(3)12-13/h13-14,16-17H,4-12H2,1-3H3
InChIKeyAUZGGWPOFXCXDI-UHFFFAOYSA-N
XLogP1.84
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5,5-dimethyl-N-[(1-methylpiperidin-3-yl)methyl]pyrrolidin-3-amine
CID 115145951
2,2,6,6-tetramethyl-N-[(1-methylpiperidin-3-yl)methyl]piperidin-4-amine
CID 62655614
2,2-dimethyl-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]piperidin-4-amine
CID 115145658
N-(2-cyclohexylethyl)-5,5-dimethylpyrrolidin-3-amine
CID 115146067
1-methyl-3-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine
CID 117271478
1-methyl-N-(2-pyrrolidin-2-ylethyl)piperidin-3-amine
CID 115210185
N,2,2-trimethyl-N-[2-(1-methylpyrrolidin-3-yl)ethyl]piperidin-4-amine
CID 115145636
N-(2-cyclobutylethyl)-1-methylpiperidin-4-amine
CID 115893453
N-methyl-N'-[2-(1-methylpiperidin-3-yl)ethyl]ethane-1,2-diamine
CID 115196067
2-(1-methylpiperidin-3-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 115208430
N-[2-(4-fluorophenyl)ethyl]-2,2-dimethylpiperidin-4-amine
CID 115145574
N-(2-cyclopentyl-2-methylpropyl)-2,2-dimethylpiperidin-4-amine
CID 115145654

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine?
The IUPAC name of 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine (CID 115145605) is 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine.
What is the SMILES notation for 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine?
The canonical SMILES for 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine is CN1CCCC(CCNC2CCNC(C)(C)C2)C1.
What is the InChIKey of 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine?
The InChIKey is AUZGGWPOFXCXDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-15(2)11-14(7-9-17-15)16-8-6-13-5-4-10-18(3)12-13/h13-14,16-17H,4-12H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine?
2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine has a molecular weight of 253.43 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-(1-methylpiperidin-3-yl)ethyl]piperidin-4-amine is sourced from PubChem (CID 115145605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).