5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine

C12H20N4 — CID 67549505

IUPAC5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine
SMILESCC1CN(c2ccc(N)nc2)C(C)CN1C
InChIInChI=1S/C12H20N4/c1-9-8-16(10(2)7-15(9)3)11-4-5-12(13)14-6-11/h4-6,9-10H,7-8H2,1-3H3,(H2,13,14)
InChIKeyCXXRVEHULLUXQQ-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.19
Rot. Bonds1

About 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine

5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine (PubChem CID 67549505) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine
PubChem CID67549505
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine
SMILESCC1CN(c2ccc(N)nc2)C(C)CN1C
InChIInChI=1S/C12H20N4/c1-9-8-16(10(2)7-15(9)3)11-4-5-12(13)14-6-11/h4-6,9-10H,7-8H2,1-3H3,(H2,13,14)
InChIKeyCXXRVEHULLUXQQ-UHFFFAOYSA-N
XLogP1.19
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine?
The IUPAC name of 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine (CID 67549505) is 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine.
What is the SMILES notation for 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine?
The canonical SMILES for 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine is CC1CN(c2ccc(N)nc2)C(C)CN1C.
What is the InChIKey of 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine?
The InChIKey is CXXRVEHULLUXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9-8-16(10(2)7-15(9)3)11-4-5-12(13)14-6-11/h4-6,9-10H,7-8H2,1-3H3,(H2,13,14).
What are the key properties of 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine?
5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4,5-trimethylpiperazin-1-yl)pyridin-2-amine is sourced from PubChem (CID 67549505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).