1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide

C16H22N2O3 — CID 110887525

IUPAC1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide
SMILESCN(CCO)C(=O)C1CCCCN1C(=O)c1ccccc1
InChIInChI=1S/C16H22N2O3/c1-17(11-12-19)16(21)14-9-5-6-10-18(14)15(20)13-7-3-2-4-8-13/h2-4,7-8,14,19H,5-6,9-12H2,1H3
InChIKeyIKNVIPPTCGPNRW-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.13
Rot. Bonds4

About 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide

1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide (PubChem CID 110887525) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide
PubChem CID110887525
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide
SMILESCN(CCO)C(=O)C1CCCCN1C(=O)c1ccccc1
InChIInChI=1S/C16H22N2O3/c1-17(11-12-19)16(21)14-9-5-6-10-18(14)15(20)13-7-3-2-4-8-13/h2-4,7-8,14,19H,5-6,9-12H2,1H3
InChIKeyIKNVIPPTCGPNRW-UHFFFAOYSA-N
XLogP1.13
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzoyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 110887535
2-[[1-(4-bromobenzoyl)pyrrolidine-2-carbonyl]-methylamino]acetic acid
CID 119172337
3-[[1-(furan-2-carbonyl)piperidine-2-carbonyl]-methylamino]propanoic acid
CID 119232964
(2S)-1-benzoyl-N,N-dimethylpiperidine-2-carboxamide;1-[(2S)-1-benzylpiperidin-2-yl]-N,N-dimethylmethanamine
CID 161257703
N-methyl-1-(pyridine-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide
CID 71998761
2-methylpropyl 1-benzoylpiperidine-2-carboxylate
CID 100995685
(2S)-1-benzoylpyrrolidine-2-carboxylate
CID 6988238
(2-hydroxypiperidin-1-yl)-phenylmethanone
CID 14920288
3-[[1-(1,3-benzodioxole-5-carbonyl)pyrrolidine-2-carbonyl]-methylamino]propanoic acid
CID 119233054
N-benzyl-N-(2-hydroxyethyl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 78855278
(2R)-1-[3-(dimethylamino)benzoyl]piperidine-2-carboxylic acid
CID 79034431
(2S)-1-[3-(dimethylcarbamoyl)benzoyl]piperidine-2-carboxylic acid
CID 99713728

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide?
The IUPAC name of 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide (CID 110887525) is 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide?
The canonical SMILES for 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide is CN(CCO)C(=O)C1CCCCN1C(=O)c1ccccc1.
What is the InChIKey of 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide?
The InChIKey is IKNVIPPTCGPNRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-17(11-12-19)16(21)14-9-5-6-10-18(14)15(20)13-7-3-2-4-8-13/h2-4,7-8,14,19H,5-6,9-12H2,1H3.
What are the key properties of 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide?
1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-(2-hydroxyethyl)-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 110887525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).