N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine

C15H32N2 — CID 62569003

IUPACN-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine
SMILESCCC(CC)NCC(C)N1CCC(C)CC1C
InChIInChI=1S/C15H32N2/c1-6-15(7-2)16-11-14(5)17-9-8-12(3)10-13(17)4/h12-16H,6-11H2,1-5H3
InChIKeyMOXOLDWFXZXBMY-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.27
Rot. Bonds6

About N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine

N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine (PubChem CID 62569003) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine.

Molecular Properties

Compound NameN-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine
PubChem CID62569003
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine
SMILESCCC(CC)NCC(C)N1CCC(C)CC1C
InChIInChI=1S/C15H32N2/c1-6-15(7-2)16-11-14(5)17-9-8-12(3)10-13(17)4/h12-16H,6-11H2,1-5H3
InChIKeyMOXOLDWFXZXBMY-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine?
The IUPAC name of N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine (CID 62569003) is N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine.
What is the SMILES notation for N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine?
The canonical SMILES for N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine is CCC(CC)NCC(C)N1CCC(C)CC1C.
What is the InChIKey of N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine?
The InChIKey is MOXOLDWFXZXBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-6-15(7-2)16-11-14(5)17-9-8-12(3)10-13(17)4/h12-16H,6-11H2,1-5H3.
What are the key properties of N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine?
N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine has a molecular weight of 240.43 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dimethylpiperidin-1-yl)propyl]pentan-3-amine is sourced from PubChem (CID 62569003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).