1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide

C10H20N2O3 — CID 82849638

IUPAC1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1CC(O)CO
InChIInChI=1S/C10H20N2O3/c1-7-2-3-8(10(11)15)4-12(7)5-9(14)6-13/h7-9,13-14H,2-6H2,1H3,(H2,11,15)
InChIKeyGWDLSYROXZMDOQ-UHFFFAOYSA-N
MW216.28 g/mol
LogP-1.07
Rot. Bonds4

About 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide

1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide (PubChem CID 82849638) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide
PubChem CID82849638
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1CC(O)CO
InChIInChI=1S/C10H20N2O3/c1-7-2-3-8(10(11)15)4-12(7)5-9(14)6-13/h7-9,13-14H,2-6H2,1H3,(H2,11,15)
InChIKeyGWDLSYROXZMDOQ-UHFFFAOYSA-N
XLogP-1.07
TPSA86.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-1.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide (CID 82849638) is 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1CC(O)CO.
What is the InChIKey of 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide?
The InChIKey is GWDLSYROXZMDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-7-2-3-8(10(11)15)4-12(7)5-9(14)6-13/h7-9,13-14H,2-6H2,1H3,(H2,11,15).
What are the key properties of 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide?
1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide has a molecular weight of 216.28 g/mol, XLogP of -1.07, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 82849638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).