(1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine

C15H26N4 — CID 83122532

IUPAC(1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine
SMILESCC(C)CN1CCN(c2ccc([C@@H](C)N)nc2)CC1
InChIInChI=1S/C15H26N4/c1-12(2)11-18-6-8-19(9-7-18)14-4-5-15(13(3)16)17-10-14/h4-5,10,12-13H,6-9,11,16H2,1-3H3/t13-/m1/s1
InChIKeyUIUOTGZUOZJKOE-CYBMUJFWSA-N
MW262.40 g/mol
LogP1.88
Rot. Bonds4

About (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine

(1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine (PubChem CID 83122532) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine
PubChem CID83122532
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name(1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine
SMILESCC(C)CN1CCN(c2ccc([C@@H](C)N)nc2)CC1
InChIInChI=1S/C15H26N4/c1-12(2)11-18-6-8-19(9-7-18)14-4-5-15(13(3)16)17-10-14/h4-5,10,12-13H,6-9,11,16H2,1-3H3/t13-/m1/s1
InChIKeyUIUOTGZUOZJKOE-CYBMUJFWSA-N
XLogP1.88
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine?
The IUPAC name of (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine (CID 83122532) is (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine.
What is the SMILES notation for (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine?
The canonical SMILES for (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine is CC(C)CN1CCN(c2ccc([C@@H](C)N)nc2)CC1.
What is the InChIKey of (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine?
The InChIKey is UIUOTGZUOZJKOE-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H26N4/c1-12(2)11-18-6-8-19(9-7-18)14-4-5-15(13(3)16)17-10-14/h4-5,10,12-13H,6-9,11,16H2,1-3H3/t13-/m1/s1.
What are the key properties of (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine?
(1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine has a molecular weight of 262.40 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]ethanamine is sourced from PubChem (CID 83122532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).