N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide

C10H20N2O3 — CID 107068312

IUPACN-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)NCC(O)CO
InChIInChI=1S/C10H20N2O3/c1-7-3-2-4-11-9(7)10(15)12-5-8(14)6-13/h7-9,11,13-14H,2-6H2,1H3,(H,12,15)
InChIKeyIZLJXHALJHRTGG-UHFFFAOYSA-N
MW216.28 g/mol
LogP-1.16
Rot. Bonds4

About N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide

N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide (PubChem CID 107068312) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide
PubChem CID107068312
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC NameN-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)NCC(O)CO
InChIInChI=1S/C10H20N2O3/c1-7-3-2-4-11-9(7)10(15)12-5-8(14)6-13/h7-9,11,13-14H,2-6H2,1H3,(H,12,15)
InChIKeyIZLJXHALJHRTGG-UHFFFAOYSA-N
XLogP-1.16
TPSA81.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-1.16
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-2-hydroxypropyl]-3-methylpiperidine-2-carboxamide
CID 107221242
N-(2,3-dimethylbutyl)-3-methylpiperidine-2-carboxamide
CID 64599745
N-(2,3-dihydroxypropyl)piperidine-2-carboxamide
CID 66170810
2-hydroxy-4-[(3-methylpiperidine-2-carbonyl)amino]butanoic acid
CID 107835996
N-(2-amino-2-oxoethyl)-3-methylpiperidine-2-carboxamide
CID 62338928
N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide
CID 62338768
(2R)-3-hydroxy-2-[(3-methylpiperidine-2-carbonyl)amino]propanoic acid
CID 107068392
N-(2,3-dihydroxypropyl)piperidine-3-carboxamide
CID 66169749
2-[[(3-methylpiperidine-2-carbonyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 107068302
N-[(2R)-2,3-dihydroxypropyl]cyclobutanecarboxamide
CID 165487313
N-(2-chloroprop-2-enyl)-3-methylpiperidine-2-carboxamide
CID 107068571
2-methyl-2-[(3-methylpiperidine-2-carbonyl)amino]propanoic acid
CID 107068050

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide?
The IUPAC name of N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide (CID 107068312) is N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide is CC1CCCNC1C(=O)NCC(O)CO.
What is the InChIKey of N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide?
The InChIKey is IZLJXHALJHRTGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-7-3-2-4-11-9(7)10(15)12-5-8(14)6-13/h7-9,11,13-14H,2-6H2,1H3,(H,12,15).
What are the key properties of N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide?
N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide has a molecular weight of 216.28 g/mol, XLogP of -1.16, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxypropyl)-3-methylpiperidine-2-carboxamide is sourced from PubChem (CID 107068312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).