N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

C15H23N3O3 — CID 131895752

IUPACN-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NCCCN2CCCC(O)C2)c(=O)[nH]1
InChIInChI=1S/C15H23N3O3/c1-11-5-6-13(15(21)17-11)14(20)16-7-3-9-18-8-2-4-12(19)10-18/h5-6,12,19H,2-4,7-10H2,1H3,(H,16,20)(H,17,21)
InChIKeyYJAKGJYKSBJKIS-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.26
Rot. Bonds5

About N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 131895752) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID131895752
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NCCCN2CCCC(O)C2)c(=O)[nH]1
InChIInChI=1S/C15H23N3O3/c1-11-5-6-13(15(21)17-11)14(20)16-7-3-9-18-8-2-4-12(19)10-18/h5-6,12,19H,2-4,7-10H2,1H3,(H,16,20)(H,17,21)
InChIKeyYJAKGJYKSBJKIS-UHFFFAOYSA-N
XLogP0.26
TPSA85.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-N-[3-[(3R)-3-hydroxypiperidin-1-yl]propyl]-5-methyl-1H-pyrazole-3-carboxamide
CID 125155609
N-(6-hydroxyhexyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 113351778
N-[3-(4-methylpiperazin-1-yl)propyl]-2-oxo-6-propan-2-yl-1H-pyridine-3-carboxamide
CID 74234352
4-fluoro-3-hydroxy-N-[3-[(3R)-3-hydroxypiperidin-1-yl]propyl]benzamide
CID 125170855
6-methyl-N-[[1-[(E)-2-methylpent-2-enyl]piperidin-3-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 56716835
4-(6-amino-2-methyl-3-pyridinyl)-N-[3-[(3S)-3-hydroxypiperidin-1-yl]propyl]benzamide
CID 126436627
N-[3-(3-hydroxypyrrolidin-1-yl)propyl]-3,5-dimethylbenzamide
CID 142245443
3-(3-hydroxy-3-methylbutyl)-N-[3-[(3S)-3-hydroxypiperidin-1-yl]propyl]benzamide
CID 95873193
6-[4-[3-(3-hydroxypiperidin-1-yl)propylcarbamoyl]phenyl]pyridine-3-carboxamide
CID 119064664
N-[[(3R)-1-(4-fluorophenyl)pyrrolidin-3-yl]methyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 95149559
4-chloro-2-fluoro-N-[3-[(3S)-3-methylpiperidin-1-yl]propyl]benzamide
CID 94119720
3-[3-(3-hydroxypiperidin-1-yl)propylcarbamoylamino]propanoic acid
CID 131931427

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 131895752) is N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(C(=O)NCCCN2CCCC(O)C2)c(=O)[nH]1.
What is the InChIKey of N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is YJAKGJYKSBJKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-11-5-6-13(15(21)17-11)14(20)16-7-3-9-18-8-2-4-12(19)10-18/h5-6,12,19H,2-4,7-10H2,1H3,(H,16,20)(H,17,21).
What are the key properties of N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-hydroxypiperidin-1-yl)propyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 131895752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).