2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine

C20H26N6 — CID 126893435

IUPAC2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine
SMILESCc1cc(N2CC(N3CCN(c4ccccn4)CC3)C2)nc(C2CC2)n1
InChIInChI=1S/C20H26N6/c1-15-12-19(23-20(22-15)16-5-6-16)26-13-17(14-26)24-8-10-25(11-9-24)18-4-2-3-7-21-18/h2-4,7,12,16-17H,5-6,8-11,13-14H2,1H3
InChIKeyNTDUKBYLGFRUNK-UHFFFAOYSA-N
MW350.47 g/mol
LogP2.07
Rot. Bonds4

About 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine

2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine (PubChem CID 126893435) has the molecular formula C20H26N6 and a molecular weight of 350.47 g/mol. Its IUPAC name is 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine.

Molecular Properties

Compound Name2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine
PubChem CID126893435
Molecular FormulaC20H26N6
Molecular Weight350.47 g/mol
Exact Mass350.22
IUPAC Name2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine
SMILESCc1cc(N2CC(N3CCN(c4ccccn4)CC3)C2)nc(C2CC2)n1
InChIInChI=1S/C20H26N6/c1-15-12-19(23-20(22-15)16-5-6-16)26-13-17(14-26)24-8-10-25(11-9-24)18-4-2-3-7-21-18/h2-4,7,12,16-17H,5-6,8-11,13-14H2,1H3
InChIKeyNTDUKBYLGFRUNK-UHFFFAOYSA-N
XLogP2.07
TPSA48.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.47
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine with MolForge

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Related Compounds

2-cyclobutyl-4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine
CID 126893632
2-cyclopropyl-4-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]pyrimidine
CID 126893499
N-cyclopropyl-4-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-amine
CID 112907588
N-cycloheptyl-4-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-amine
CID 112923831
1-(1-cyclohexylazetidin-3-yl)-4-pyridin-2-ylpiperazine
CID 126893395
8-[4-(2-cyclopropyl-6-methylpyrimidin-4-yl)piperazin-1-yl]imidazo[1,2-a]pyrazine
CID 166605243
3-(4-pyridin-2-ylpiperazin-1-yl)azetidine-1-carbaldehyde
CID 123583794
4-[1-(2-cyclopropyl-6-methylpyrimidin-4-yl)piperidin-3-yl]morpholine
CID 172899302
4-methyl-6-(3-methylpiperidin-1-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine
CID 112923898
2-cyclopropyl-4-methyl-6-[4-(4-pyridin-4-ylpyrimidin-2-yl)piperazin-1-yl]pyrimidine
CID 163348410
N-butyl-4-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-amine
CID 112908336
4-[3-(4-bromopyrazol-1-yl)azetidin-1-yl]-2-cyclopropyl-6-methylpyrimidine
CID 126901358

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine?
The IUPAC name of 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine (CID 126893435) is 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine.
What is the SMILES notation for 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine?
The canonical SMILES for 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine is Cc1cc(N2CC(N3CCN(c4ccccn4)CC3)C2)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine?
The InChIKey is NTDUKBYLGFRUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N6/c1-15-12-19(23-20(22-15)16-5-6-16)26-13-17(14-26)24-8-10-25(11-9-24)18-4-2-3-7-21-18/h2-4,7,12,16-17H,5-6,8-11,13-14H2,1H3.
What are the key properties of 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine?
2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine has a molecular weight of 350.47 g/mol, XLogP of 2.07, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine is sourced from PubChem (CID 126893435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).