4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide

C15H26N2O3 — CID 164631481

IUPAC4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide
SMILESC[C@@H](CNC(=O)C1CCC(O)CC1)N1CCCCC1=O
InChIInChI=1S/C15H26N2O3/c1-11(17-9-3-2-4-14(17)19)10-16-15(20)12-5-7-13(18)8-6-12/h11-13,18H,2-10H2,1H3,(H,16,20)/t11-,12?,13?/m0/s1
InChIKeyMUSWTZWXXNQOLD-HIFPTAJRSA-N
MW282.38 g/mol
LogP1.05
Rot. Bonds4

About 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide

4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide (PubChem CID 164631481) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide
PubChem CID164631481
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide
SMILESC[C@@H](CNC(=O)C1CCC(O)CC1)N1CCCCC1=O
InChIInChI=1S/C15H26N2O3/c1-11(17-9-3-2-4-14(17)19)10-16-15(20)12-5-7-13(18)8-6-12/h11-13,18H,2-10H2,1H3,(H,16,20)/t11-,12?,13?/m0/s1
InChIKeyMUSWTZWXXNQOLD-HIFPTAJRSA-N
XLogP1.05
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide?
The IUPAC name of 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide (CID 164631481) is 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide?
The canonical SMILES for 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide is C[C@@H](CNC(=O)C1CCC(O)CC1)N1CCCCC1=O.
What is the InChIKey of 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide?
The InChIKey is MUSWTZWXXNQOLD-HIFPTAJRSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-11(17-9-3-2-4-14(17)19)10-16-15(20)12-5-7-13(18)8-6-12/h11-13,18H,2-10H2,1H3,(H,16,20)/t11-,12?,13?/m0/s1.
What are the key properties of 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide?
4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide has a molecular weight of 282.38 g/mol, XLogP of 1.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(2S)-2-(2-oxopiperidin-1-yl)propyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 164631481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).