4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine

C14H18N6 — CID 62959098

IUPAC4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine
SMILESCc1ccnc(N2CCN(c3ccncc3N)CC2)n1
InChIInChI=1S/C14H18N6/c1-11-2-5-17-14(18-11)20-8-6-19(7-9-20)13-3-4-16-10-12(13)15/h2-5,10H,6-9,15H2,1H3
InChIKeyVEOICTKVRPMVHG-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.09
Rot. Bonds2

About 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine

4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine (PubChem CID 62959098) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine
PubChem CID62959098
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine
SMILESCc1ccnc(N2CCN(c3ccncc3N)CC2)n1
InChIInChI=1S/C14H18N6/c1-11-2-5-17-14(18-11)20-8-6-19(7-9-20)13-3-4-16-10-12(13)15/h2-5,10H,6-9,15H2,1H3
InChIKeyVEOICTKVRPMVHG-UHFFFAOYSA-N
XLogP1.09
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine?
The IUPAC name of 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine (CID 62959098) is 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine.
What is the SMILES notation for 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine?
The canonical SMILES for 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine is Cc1ccnc(N2CCN(c3ccncc3N)CC2)n1.
What is the InChIKey of 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine?
The InChIKey is VEOICTKVRPMVHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-11-2-5-17-14(18-11)20-8-6-19(7-9-20)13-3-4-16-10-12(13)15/h2-5,10H,6-9,15H2,1H3.
What are the key properties of 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine?
4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine has a molecular weight of 270.34 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine is sourced from PubChem (CID 62959098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).