3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione

C19H26N2O3 — CID 170325392

IUPAC3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione
SMILESO=C1CCC(c2cccc(N3CCC(CCCO)CC3)c2)C(=O)N1
InChIInChI=1S/C19H26N2O3/c22-12-2-3-14-8-10-21(11-9-14)16-5-1-4-15(13-16)17-6-7-18(23)20-19(17)24/h1,4-5,13-14,17,22H,2-3,6-12H2,(H,20,23,24)
InChIKeyXYGBMXOJKIJURB-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.20
Rot. Bonds5

About 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione

3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione (PubChem CID 170325392) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione.

Molecular Properties

Compound Name3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione
PubChem CID170325392
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC Name3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione
SMILESO=C1CCC(c2cccc(N3CCC(CCCO)CC3)c2)C(=O)N1
InChIInChI=1S/C19H26N2O3/c22-12-2-3-14-8-10-21(11-9-14)16-5-1-4-15(13-16)17-6-7-18(23)20-19(17)24/h1,4-5,13-14,17,22H,2-3,6-12H2,(H,20,23,24)
InChIKeyXYGBMXOJKIJURB-UHFFFAOYSA-N
XLogP2.20
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

3-[3-[4-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-1-yl]phenyl]piperidine-2,6-dione
CID 177052114
3-[3-[7-(2-cyclohexylethyl)-2,7-diazaspiro[3.5]nonan-2-yl]phenyl]piperidine-2,6-dione
CID 171406919
3-[3-[9-(2-aminoethyl)-3,9-diazaspiro[5.5]undecan-3-yl]phenyl]piperidine-2,6-dione
CID 177052731
3-[3-(2,7-diazaspiro[3.5]nonan-2-yl)phenyl]piperidine-2,6-dione
CID 170979872
ethane;3-[3-(3-piperazin-1-ylazetidin-1-yl)phenyl]piperidine-2,6-dione
CID 177363109
3-[6-[4-(2-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]piperidine-2,6-dione
CID 166112962
tert-butyl 6-[3-(2,6-dioxopiperidin-3-yl)phenyl]-2,6-diazaspiro[3.3]heptane-2-carboxylate;ethane
CID 170979336
3-[4-[4-[4-(hydroxymethyl)cyclohexyl]piperazin-1-yl]phenyl]piperidine-2,6-dione
CID 170325363
[1-[4-(2,6-dioxopiperidin-3-yl)phenyl]piperidin-4-yl]methylcarbamic acid
CID 174225411
molecular hydrogen;piperidin-4-amine;3-[3-[3-(piperidine-4-carbonyl)-3,9-diazaspiro[5.5]undecan-9-yl]phenyl]piperidine-2,6-dione;sulfanol;hydrate
CID 177052955
CID 177052361
CID 177052361
3-[5-[4-(2-methylpropyl)piperidin-1-yl]-3-pyridinyl]piperidine-2,6-dione
CID 178116295

Frequently Asked Questions

What is the IUPAC name of 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione?
The IUPAC name of 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione (CID 170325392) is 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione.
What is the SMILES notation for 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione?
The canonical SMILES for 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione is O=C1CCC(c2cccc(N3CCC(CCCO)CC3)c2)C(=O)N1.
What is the InChIKey of 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione?
The InChIKey is XYGBMXOJKIJURB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c22-12-2-3-14-8-10-21(11-9-14)16-5-1-4-15(13-16)17-6-7-18(23)20-19(17)24/h1,4-5,13-14,17,22H,2-3,6-12H2,(H,20,23,24).
What are the key properties of 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione?
3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione has a molecular weight of 330.43 g/mol, XLogP of 2.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[4-(3-hydroxypropyl)piperidin-1-yl]phenyl]piperidine-2,6-dione is sourced from PubChem (CID 170325392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).