N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide

C12H22N2O3 — CID 110900000

IUPACN-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide
SMILESCCC(=O)N1CCCC(C(=O)N(C)CCO)C1
InChIInChI=1S/C12H22N2O3/c1-3-11(16)14-6-4-5-10(9-14)12(17)13(2)7-8-15/h10,15H,3-9H2,1-2H3
InChIKeyFWVIUHISLYIWSW-UHFFFAOYSA-N
MW242.32 g/mol
LogP0.09
Rot. Bonds4

About N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide

N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide (PubChem CID 110900000) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide
PubChem CID110900000
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC NameN-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide
SMILESCCC(=O)N1CCCC(C(=O)N(C)CCO)C1
InChIInChI=1S/C12H22N2O3/c1-3-11(16)14-6-4-5-10(9-14)12(17)13(2)7-8-15/h10,15H,3-9H2,1-2H3
InChIKeyFWVIUHISLYIWSW-UHFFFAOYSA-N
XLogP0.09
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(2-hydroxyethyl)-1-N,1-N,3-N-trimethylpiperidine-1,3-dicarboxamide
CID 60778381
1-butanoyl-N-(3-hydroxybutyl)-N-methylpiperidine-3-carboxamide
CID 111695757
3-N-(5-hydroxypentyl)-1-N,1-N,3-N-trimethylpiperidine-1,3-dicarboxamide
CID 107202052
N-(3-amino-4-methylpentyl)-1-butanoyl-N-methylpiperidine-3-carboxamide
CID 119660200
3-N,3-N-bis(2-hydroxyethyl)-1-N,1-N-dimethylpiperidine-1,3-dicarboxamide
CID 61233623
1-(cyclopropanecarbonyl)-N,N-bis(2-hydroxyethyl)piperidine-3-carboxamide
CID 61233609
N-(2-hydroxyethyl)-N-methylpiperidine-1-carboxamide
CID 68606002
3-[[1-(dimethylcarbamoyl)piperidine-3-carbonyl]-methylamino]propanoic acid
CID 60988420
N-ethyl-1-propanoylpiperidine-3-carboxamide
CID 68576487
N,N-dimethyl-1-pentanoylpiperidine-3-carboxamide
CID 60601624
N-[2-(dimethylamino)-2-oxoethyl]-1-propanoyl-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 87025475
1-(cyclopropanecarbonyl)-N-(2-hydroxyethyl)-N-propan-2-ylpiperidine-3-carboxamide
CID 43573446

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide (CID 110900000) is N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide is CCC(=O)N1CCCC(C(=O)N(C)CCO)C1.
What is the InChIKey of N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide?
The InChIKey is FWVIUHISLYIWSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-3-11(16)14-6-4-5-10(9-14)12(17)13(2)7-8-15/h10,15H,3-9H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide?
N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide has a molecular weight of 242.32 g/mol, XLogP of 0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide is sourced from PubChem (CID 110900000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).