N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide

C11H20N2O4 — CID 103850894

IUPACN-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide
SMILESCOCC(CCO)NC(=O)C1CCC(=O)NC1
InChIInChI=1S/C11H20N2O4/c1-17-7-9(4-5-14)13-11(16)8-2-3-10(15)12-6-8/h8-9,14H,2-7H2,1H3,(H,12,15)(H,13,16)
InChIKeyGXTNPERPCSOIGH-UHFFFAOYSA-N
MW244.29 g/mol
LogP-0.97
Rot. Bonds6

About N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide

N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide (PubChem CID 103850894) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide
PubChem CID103850894
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC NameN-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide
SMILESCOCC(CCO)NC(=O)C1CCC(=O)NC1
InChIInChI=1S/C11H20N2O4/c1-17-7-9(4-5-14)13-11(16)8-2-3-10(15)12-6-8/h8-9,14H,2-7H2,1H3,(H,12,15)(H,13,16)
InChIKeyGXTNPERPCSOIGH-UHFFFAOYSA-N
XLogP-0.97
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-0.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-4-hydroxy-2-[(6-oxopiperidine-3-carbonyl)amino]butanoic acid
CID 107822931
N-(4-hydroxy-1-methoxybutan-2-yl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106160965
N-(1-methylsulfanylbutan-2-yl)-6-oxopiperidine-3-carboxamide
CID 115900350
N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide
CID 103274805
N-(3-ethylpentan-2-yl)-6-oxopiperidine-3-carboxamide
CID 78952778
(2S,3S)-3-methyl-2-[[(3R)-6-oxopiperidine-3-carbonyl]amino]pentanoic acid
CID 129380712
N-[3-(2-methoxyethoxy)propyl]-6-oxopiperidine-3-carboxamide
CID 112728621
4-butyl-N-(4-hydroxy-1-methoxybutan-2-yl)cyclohexane-1-carboxamide
CID 103799364
(2S)-2-[(6-oxopiperidine-3-carbonyl)amino]pentanedioic acid
CID 83193700
N-[3-(2-methoxyethylamino)-3-oxopropyl]-6-oxopiperidine-3-carboxamide
CID 112686353
N-[1-(cyclopropylamino)-1-oxopropan-2-yl]-6-oxopiperidine-3-carboxamide
CID 113408101
(2S)-5-ethoxy-5-oxo-2-[(6-oxopiperidine-3-carbonyl)amino]pentanoic acid
CID 107039270

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide (CID 103850894) is N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide is COCC(CCO)NC(=O)C1CCC(=O)NC1.
What is the InChIKey of N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide?
The InChIKey is GXTNPERPCSOIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-17-7-9(4-5-14)13-11(16)8-2-3-10(15)12-6-8/h8-9,14H,2-7H2,1H3,(H,12,15)(H,13,16).
What are the key properties of N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide?
N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide has a molecular weight of 244.29 g/mol, XLogP of -0.97, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 103850894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).