2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine

C14H17N5 — CID 59676617

IUPAC2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
SMILESCc1ccc(N2CCN(c3ncccn3)CC2)nc1
InChIInChI=1S/C14H17N5/c1-12-3-4-13(17-11-12)18-7-9-19(10-8-18)14-15-5-2-6-16-14/h2-6,11H,7-10H2,1H3
InChIKeyZURCVMMJKPXIOC-UHFFFAOYSA-N
MW255.33 g/mol
LogP1.51
Rot. Bonds2

About 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine

2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine (PubChem CID 59676617) has the molecular formula C14H17N5 and a molecular weight of 255.33 g/mol. Its IUPAC name is 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine.

Molecular Properties

Compound Name2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
PubChem CID59676617
Molecular FormulaC14H17N5
Molecular Weight255.33 g/mol
Exact Mass255.15
IUPAC Name2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
SMILESCc1ccc(N2CCN(c3ncccn3)CC2)nc1
InChIInChI=1S/C14H17N5/c1-12-3-4-13(17-11-12)18-7-9-19(10-8-18)14-15-5-2-6-16-14/h2-6,11H,7-10H2,1H3
InChIKeyZURCVMMJKPXIOC-UHFFFAOYSA-N
XLogP1.51
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.33
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 59766715
CID 59766715
ethane;2-[4-(5-fluoro-2-pyridinyl)piperazin-1-yl]-5-methylpyrimidine
CID 178161753
butane;5-methyl-2-piperidin-1-ylpyridine
CID 170641231
ethane;1-(5-methyl-2-pyridinyl)-4-methylsulfonylpiperazine
CID 143863753
1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine
CID 171337954
[4-(5-methyl-2-pyridinyl)piperazin-1-yl]-pyridin-4-ylmethanone
CID 59676606
1-(5-methyl-2-pyridinyl)-4-(2-methylsulfanylethyl)piperazine
CID 143774965
4-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]butan-1-amine
CID 43252517
4-(4-tert-butylpiperazin-1-yl)-6-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
CID 171429593
2-[4-(5-methylpyrimidin-2-yl)piperazin-1-yl]pyridin-3-amine
CID 63205864
8-(5-methyl-2-pyridinyl)-1,4-dioxa-8-azaspiro[4.5]decane
CID 79026576
4-(4-methylphenyl)-1-pyrimidin-2-ylpiperidin-4-ol
CID 95811440

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine?
The IUPAC name of 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine (CID 59676617) is 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine.
What is the SMILES notation for 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine?
The canonical SMILES for 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine is Cc1ccc(N2CCN(c3ncccn3)CC2)nc1.
What is the InChIKey of 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine?
The InChIKey is ZURCVMMJKPXIOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5/c1-12-3-4-13(17-11-12)18-7-9-19(10-8-18)14-15-5-2-6-16-14/h2-6,11H,7-10H2,1H3.
What are the key properties of 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine?
2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine has a molecular weight of 255.33 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine is sourced from PubChem (CID 59676617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).