[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone

C10H18N2O3 — CID 107222846

IUPAC[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone
SMILESO=C(C1CNCCO1)N1CCC[C@H](O)C1
InChIInChI=1S/C10H18N2O3/c13-8-2-1-4-12(7-8)10(14)9-6-11-3-5-15-9/h8-9,11,13H,1-7H2/t8-,9?/m0/s1
InChIKeyBMXBTUSJFSCRPK-IENPIDJESA-N
MW214.26 g/mol
LogP-1.04
Rot. Bonds1

About [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone

[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone (PubChem CID 107222846) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone.

Molecular Properties

Compound Name[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone
PubChem CID107222846
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone
SMILESO=C(C1CNCCO1)N1CCC[C@H](O)C1
InChIInChI=1S/C10H18N2O3/c13-8-2-1-4-12(7-8)10(14)9-6-11-3-5-15-9/h8-9,11,13H,1-7H2/t8-,9?/m0/s1
InChIKeyBMXBTUSJFSCRPK-IENPIDJESA-N
XLogP-1.04
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-1.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone?
The IUPAC name of [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone (CID 107222846) is [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone.
What is the SMILES notation for [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone?
The canonical SMILES for [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone is O=C(C1CNCCO1)N1CCC[C@H](O)C1.
What is the InChIKey of [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone?
The InChIKey is BMXBTUSJFSCRPK-IENPIDJESA-N. The full InChI is InChI=1S/C10H18N2O3/c13-8-2-1-4-12(7-8)10(14)9-6-11-3-5-15-9/h8-9,11,13H,1-7H2/t8-,9?/m0/s1.
What are the key properties of [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone?
[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone has a molecular weight of 214.26 g/mol, XLogP of -1.04, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone is sourced from PubChem (CID 107222846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).