4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine

C10H11ClN6O — CID 55210935

IUPAC4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine
SMILESClc1nc(N2CCOCC2)nc(-n2cccn2)n1
InChIInChI=1S/C10H11ClN6O/c11-8-13-9(16-4-6-18-7-5-16)15-10(14-8)17-3-1-2-12-17/h1-3H,4-7H2
InChIKeyYIIVIKGPHGCQLE-UHFFFAOYSA-N
MW266.69 g/mol
LogP0.55
Rot. Bonds2

About 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine

4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine (PubChem CID 55210935) has the molecular formula C10H11ClN6O and a molecular weight of 266.69 g/mol. Its IUPAC name is 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine
PubChem CID55210935
Molecular FormulaC10H11ClN6O
Molecular Weight266.69 g/mol
Exact Mass266.07
IUPAC Name4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine
SMILESClc1nc(N2CCOCC2)nc(-n2cccn2)n1
InChIInChI=1S/C10H11ClN6O/c11-8-13-9(16-4-6-18-7-5-16)15-10(14-8)17-3-1-2-12-17/h1-3H,4-7H2
InChIKeyYIIVIKGPHGCQLE-UHFFFAOYSA-N
XLogP0.55
TPSA68.96 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.69
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine?
The IUPAC name of 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine (CID 55210935) is 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine.
What is the SMILES notation for 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine?
The canonical SMILES for 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine is Clc1nc(N2CCOCC2)nc(-n2cccn2)n1.
What is the InChIKey of 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine?
The InChIKey is YIIVIKGPHGCQLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN6O/c11-8-13-9(16-4-6-18-7-5-16)15-10(14-8)17-3-1-2-12-17/h1-3H,4-7H2.
What are the key properties of 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine?
4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine has a molecular weight of 266.69 g/mol, XLogP of 0.55, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)morpholine is sourced from PubChem (CID 55210935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).