4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine

C19H21N7 — CID 126893689

IUPAC4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine
SMILESc1ccc(N2CCN(C3CN(c4ncnc5ncccc45)C3)CC2)nc1
InChIInChI=1S/C19H21N7/c1-2-6-20-17(5-1)25-10-8-24(9-11-25)15-12-26(13-15)19-16-4-3-7-21-18(16)22-14-23-19/h1-7,14-15H,8-13H2
InChIKeyMGKKBSPKVJUUMJ-UHFFFAOYSA-N
MW347.43 g/mol
LogP1.43
Rot. Bonds3

About 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine

4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine (PubChem CID 126893689) has the molecular formula C19H21N7 and a molecular weight of 347.43 g/mol. Its IUPAC name is 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine.

Molecular Properties

Compound Name4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine
PubChem CID126893689
Molecular FormulaC19H21N7
Molecular Weight347.43 g/mol
Exact Mass347.19
IUPAC Name4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine
SMILESc1ccc(N2CCN(C3CN(c4ncnc5ncccc45)C3)CC2)nc1
InChIInChI=1S/C19H21N7/c1-2-6-20-17(5-1)25-10-8-24(9-11-25)15-12-26(13-15)19-16-4-3-7-21-18(16)22-14-23-19/h1-7,14-15H,8-13H2
InChIKeyMGKKBSPKVJUUMJ-UHFFFAOYSA-N
XLogP1.43
TPSA61.28 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

3-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyridazine-4-carbonitrile
CID 126893637
3-(4-pyridin-2-ylpiperazin-1-yl)azetidine-1-carbaldehyde
CID 123583794
1-(1-cyclohexylazetidin-3-yl)-4-pyridin-2-ylpiperazine
CID 126893395
4-(4-pyridin-2-ylpiperazin-1-yl)cyclohexan-1-amine
CID 15045421
1-[1-(3-chloro-4-pyridinyl)azetidin-3-yl]-4-pyridin-2-ylpiperazine
CID 126893375
N,N-dimethyl-6-(4-pyrido[2,3-d]pyrimidin-4-ylpiperazin-1-yl)pyrimidin-4-amine
CID 163346447
2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 126893638
1-pyridin-2-yl-4-[1-[2-(triazol-2-yl)ethyl]azetidin-3-yl]piperazine
CID 126893461
1-pyridin-2-yl-4-(1-pyrrolidin-1-ylsulfonylazetidin-3-yl)piperazine
CID 126893363
2-cyclobutyl-4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine
CID 126893632
4-[4-[6-(2-methylimidazol-1-yl)pyridazin-3-yl]piperazin-1-yl]pyrido[2,3-d]pyrimidine
CID 163345177
1-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]sulfonylazepane
CID 126893450

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine?
The IUPAC name of 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine (CID 126893689) is 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine.
What is the SMILES notation for 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine?
The canonical SMILES for 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine is c1ccc(N2CCN(C3CN(c4ncnc5ncccc45)C3)CC2)nc1.
What is the InChIKey of 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine?
The InChIKey is MGKKBSPKVJUUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N7/c1-2-6-20-17(5-1)25-10-8-24(9-11-25)15-12-26(13-15)19-16-4-3-7-21-18(16)22-14-23-19/h1-7,14-15H,8-13H2.
What are the key properties of 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine?
4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine has a molecular weight of 347.43 g/mol, XLogP of 1.43, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-d]pyrimidine is sourced from PubChem (CID 126893689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).