2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine

C14H17N5 — CID 116901846

IUPAC2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine
SMILESCN1CCNCC1c1nccc(-c2ccccn2)n1
InChIInChI=1S/C14H17N5/c1-19-9-8-15-10-13(19)14-17-7-5-12(18-14)11-4-2-3-6-16-11/h2-7,13,15H,8-10H2,1H3
InChIKeyULSIVEFNLSXXHZ-UHFFFAOYSA-N
MW255.33 g/mol
LogP1.11
Rot. Bonds2

About 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine

2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine (PubChem CID 116901846) has the molecular formula C14H17N5 and a molecular weight of 255.33 g/mol. Its IUPAC name is 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine.

Molecular Properties

Compound Name2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine
PubChem CID116901846
Molecular FormulaC14H17N5
Molecular Weight255.33 g/mol
Exact Mass255.15
IUPAC Name2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine
SMILESCN1CCNCC1c1nccc(-c2ccccn2)n1
InChIInChI=1S/C14H17N5/c1-19-9-8-15-10-13(19)14-17-7-5-12(18-14)11-4-2-3-6-16-11/h2-7,13,15H,8-10H2,1H3
InChIKeyULSIVEFNLSXXHZ-UHFFFAOYSA-N
XLogP1.11
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.33
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(5-methylfuran-2-yl)-2-(1-methylpiperazin-2-yl)pyrimidine
CID 116901849
4-(5-bromothiophen-2-yl)-2-(1-methylpiperazin-2-yl)pyrimidine
CID 116901839
3-(1-methylpiperazin-2-yl)-5-(2-pyridin-2-yl-1,3-thiazol-5-yl)-1,2,4-oxadiazole
CID 120957910
5-isoquinolin-1-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole
CID 120961025
N-[2-methyl-1-[3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazol-5-yl]propyl]pyridine-2-carboxamide;hydrochloride
CID 120956291
5-(2-methylphenyl)-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole
CID 120959013
(2R)-1-methyl-2-pyridin-4-ylpiperazine
CID 28804916
3-(1-methylpiperazin-2-yl)-5-quinolin-8-yl-1,2,4-oxadiazole
CID 120956638
5-[(E)-2-(2-methylphenyl)ethenyl]-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride
CID 120956691
(2S)-2-(2-fluorophenyl)-1-methylpiperazine
CID 28804930
pyrrolo[3,2-b]azepine
CID 66934182
1-ethyl-2-pyridin-2-yl-1,4-diazepane
CID 82283196

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine?
The IUPAC name of 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine (CID 116901846) is 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine.
What is the SMILES notation for 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine?
The canonical SMILES for 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine is CN1CCNCC1c1nccc(-c2ccccn2)n1.
What is the InChIKey of 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine?
The InChIKey is ULSIVEFNLSXXHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5/c1-19-9-8-15-10-13(19)14-17-7-5-12(18-14)11-4-2-3-6-16-11/h2-7,13,15H,8-10H2,1H3.
What are the key properties of 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine?
2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine has a molecular weight of 255.33 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine is sourced from PubChem (CID 116901846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).