morpholine;pyridine;pyrrolidine;2H-triazole

C15H26N6O — CID 174902873

IUPACmorpholine;pyridine;pyrrolidine;2H-triazole
SMILESC1CCNC1.C1COCCN1.c1ccncc1.c1cn[nH]n1
InChIInChI=1S/C5H5N.C4H9NO.C4H9N.C2H3N3/c1-2-4-6-5-3-1;1-3-6-4-2-5-1;2*1-2-4-5-3-1/h1-5H;5H,1-4H2;5H,1-4H2;1-2H,(H,3,4,5)
InChIKeyDAJDMIBHQCFJJC-UHFFFAOYSA-N
MW306.41 g/mol
LogP0.86
Rot. Bonds

About morpholine;pyridine;pyrrolidine;2H-triazole

morpholine;pyridine;pyrrolidine;2H-triazole (PubChem CID 174902873) has the molecular formula C15H26N6O and a molecular weight of 306.41 g/mol. Its IUPAC name is morpholine;pyridine;pyrrolidine;2H-triazole.

Molecular Properties

Compound Namemorpholine;pyridine;pyrrolidine;2H-triazole
PubChem CID174902873
Molecular FormulaC15H26N6O
Molecular Weight306.41 g/mol
Exact Mass306.22
IUPAC Namemorpholine;pyridine;pyrrolidine;2H-triazole
SMILESC1CCNC1.C1COCCN1.c1ccncc1.c1cn[nH]n1
InChIInChI=1S/C5H5N.C4H9NO.C4H9N.C2H3N3/c1-2-4-6-5-3-1;1-3-6-4-2-5-1;2*1-2-4-5-3-1/h1-5H;5H,1-4H2;5H,1-4H2;1-2H,(H,3,4,5)
InChIKeyDAJDMIBHQCFJJC-UHFFFAOYSA-N
XLogP0.86
TPSA87.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of morpholine;pyridine;pyrrolidine;2H-triazole?
The IUPAC name of morpholine;pyridine;pyrrolidine;2H-triazole (CID 174902873) is morpholine;pyridine;pyrrolidine;2H-triazole.
What is the SMILES notation for morpholine;pyridine;pyrrolidine;2H-triazole?
The canonical SMILES for morpholine;pyridine;pyrrolidine;2H-triazole is C1CCNC1.C1COCCN1.c1ccncc1.c1cn[nH]n1.
What is the InChIKey of morpholine;pyridine;pyrrolidine;2H-triazole?
The InChIKey is DAJDMIBHQCFJJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C4H9NO.C4H9N.C2H3N3/c1-2-4-6-5-3-1;1-3-6-4-2-5-1;2*1-2-4-5-3-1/h1-5H;5H,1-4H2;5H,1-4H2;1-2H,(H,3,4,5).
What are the key properties of morpholine;pyridine;pyrrolidine;2H-triazole?
morpholine;pyridine;pyrrolidine;2H-triazole has a molecular weight of 306.41 g/mol, XLogP of 0.86, 0 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholine;pyridine;pyrrolidine;2H-triazole is sourced from PubChem (CID 174902873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).