N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine

C14H31N3 — CID 63699039

IUPACN,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine
SMILESCN(C)CCCN(C)CCCC1CCCNC1
InChIInChI=1S/C14H31N3/c1-16(2)10-6-12-17(3)11-5-8-14-7-4-9-15-13-14/h14-15H,4-13H2,1-3H3
InChIKeyOIEWQDFVUKSLSX-UHFFFAOYSA-N
MW241.42 g/mol
LogP1.65
Rot. Bonds8

About N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine

N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine (PubChem CID 63699039) has the molecular formula C14H31N3 and a molecular weight of 241.42 g/mol. Its IUPAC name is N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine.

Molecular Properties

Compound NameN,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine
PubChem CID63699039
Molecular FormulaC14H31N3
Molecular Weight241.42 g/mol
Exact Mass241.25
IUPAC NameN,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine
SMILESCN(C)CCCN(C)CCCC1CCCNC1
InChIInChI=1S/C14H31N3/c1-16(2)10-6-12-17(3)11-5-8-14-7-4-9-15-13-14/h14-15H,4-13H2,1-3H3
InChIKeyOIEWQDFVUKSLSX-UHFFFAOYSA-N
XLogP1.65
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclobutylmethyl)-N-methyl-3-piperidin-3-ylpropan-1-amine
CID 62861568
2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine
CID 115211477
N-[3-(dimethylamino)propyl]-N-methyl-1-piperidin-3-ylmethanesulfonamide
CID 63700437
2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine
CID 115210939
(3S)-3-heptylpiperidine
CID 155456188
N-methyl-N-(piperidin-3-ylmethyl)octan-1-amine
CID 106623723
4-ethyl-N-methyl-N-(3-piperidin-3-ylpropyl)aniline
CID 62003228
N-(3-methylbutyl)-N-(3-piperidin-3-ylpropyl)cyclopropanamine
CID 78975359
N-methyl-N-[(2-methylcyclopropyl)methyl]-2-piperidin-3-ylethanamine
CID 63865515
2,2-dimethyl-5-[methyl(piperidin-3-ylmethyl)amino]pentanenitrile
CID 106636578
N-methoxy-N-methyl-3-pyrrolidin-3-ylpropan-1-amine
CID 114396537
N-methyl-N-(piperidin-3-ylmethyl)pent-4-en-1-amine
CID 115741609

Frequently Asked Questions

What is the IUPAC name of N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine?
The IUPAC name of N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine (CID 63699039) is N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine.
What is the SMILES notation for N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine?
The canonical SMILES for N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine is CN(C)CCCN(C)CCCC1CCCNC1.
What is the InChIKey of N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine?
The InChIKey is OIEWQDFVUKSLSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3/c1-16(2)10-6-12-17(3)11-5-8-14-7-4-9-15-13-14/h14-15H,4-13H2,1-3H3.
What are the key properties of N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine?
N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine has a molecular weight of 241.42 g/mol, XLogP of 1.65, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N'-trimethyl-N'-(3-piperidin-3-ylpropyl)propane-1,3-diamine is sourced from PubChem (CID 63699039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).