3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide

C12H23N3O2 — CID 71104083

IUPAC3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide
SMILESCNC(=O)C1(O)CCCN(C2CCNCC2)C1
InChIInChI=1S/C12H23N3O2/c1-13-11(16)12(17)5-2-8-15(9-12)10-3-6-14-7-4-10/h10,14,17H,2-9H2,1H3,(H,13,16)
InChIKeyVSAZCTKREBJQPI-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.69
Rot. Bonds2

About 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide

3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide (PubChem CID 71104083) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide
PubChem CID71104083
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide
SMILESCNC(=O)C1(O)CCCN(C2CCNCC2)C1
InChIInChI=1S/C12H23N3O2/c1-13-11(16)12(17)5-2-8-15(9-12)10-3-6-14-7-4-10/h10,14,17H,2-9H2,1H3,(H,13,16)
InChIKeyVSAZCTKREBJQPI-UHFFFAOYSA-N
XLogP-0.69
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-1-piperidin-4-ylpyrrolidine-3-carboxylic acid
CID 115028740
4-hydroxy-1-piperidin-4-ylazepane-4-carboxylic acid
CID 115055711
3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride
CID 156735226
5-piperidin-4-yl-5-azaspiro[2.5]octane;dihydrochloride
CID 156735083
(2R)-2-tert-butyl-N-methyl-1-piperidin-4-ylpiperidine-2-carboxamide
CID 158397052
2-piperidin-4-yl-2-azaspiro[5.5]undecan-11-one
CID 143727202
1-(azepan-4-yl)-3-methylazetidin-3-ol
CID 131182366
4-methyl-1-piperidin-4-ylpiperidin-4-ol;hydrochloride
CID 75464899
2-methyl-9-piperidin-4-yl-2,9-diazaspiro[4.5]decan-1-one;dihydrochloride
CID 68666401
2-methyl-9-piperidin-4-yl-2,9-diazaspiro[4.5]decane-1,3-dione
CID 59373321
methyl 1-piperidin-4-ylpiperidine-3-carboxylate
CID 44607682
3-ethyl-9-piperidin-4-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione
CID 59373658

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide?
The IUPAC name of 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide (CID 71104083) is 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide.
What is the SMILES notation for 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide?
The canonical SMILES for 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide is CNC(=O)C1(O)CCCN(C2CCNCC2)C1.
What is the InChIKey of 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide?
The InChIKey is VSAZCTKREBJQPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-13-11(16)12(17)5-2-8-15(9-12)10-3-6-14-7-4-10/h10,14,17H,2-9H2,1H3,(H,13,16).
What are the key properties of 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide?
3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.69, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-methyl-1-piperidin-4-ylpiperidine-3-carboxamide is sourced from PubChem (CID 71104083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).