[4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol

C8H13N3O2 — CID 126655355

IUPAC[4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol
SMILESOCC1COCCN1c1ccn[nH]1
InChIInChI=1S/C8H13N3O2/c12-5-7-6-13-4-3-11(7)8-1-2-9-10-8/h1-2,7,12H,3-6H2,(H,9,10)
InChIKeyMEIYHWWXEOWMSJ-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.39
Rot. Bonds2

About [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol

[4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol (PubChem CID 126655355) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol.

Molecular Properties

Compound Name[4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol
PubChem CID126655355
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name[4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol
SMILESOCC1COCCN1c1ccn[nH]1
InChIInChI=1S/C8H13N3O2/c12-5-7-6-13-4-3-11(7)8-1-2-9-10-8/h1-2,7,12H,3-6H2,(H,9,10)
InChIKeyMEIYHWWXEOWMSJ-UHFFFAOYSA-N
XLogP-0.39
TPSA61.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol?
The IUPAC name of [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol (CID 126655355) is [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol.
What is the SMILES notation for [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol?
The canonical SMILES for [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol is OCC1COCCN1c1ccn[nH]1.
What is the InChIKey of [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol?
The InChIKey is MEIYHWWXEOWMSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c12-5-7-6-13-4-3-11(7)8-1-2-9-10-8/h1-2,7,12H,3-6H2,(H,9,10).
What are the key properties of [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol?
[4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol has a molecular weight of 183.21 g/mol, XLogP of -0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1H-pyrazol-5-yl)morpholin-3-yl]methanol is sourced from PubChem (CID 126655355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).