N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide

C15H21N3O2 — CID 119323255

IUPACN-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide
SMILESNC(=O)CN(Cc1ccccc1)C(=O)C1CCCNC1
InChIInChI=1S/C15H21N3O2/c16-14(19)11-18(10-12-5-2-1-3-6-12)15(20)13-7-4-8-17-9-13/h1-3,5-6,13,17H,4,7-11H2,(H2,16,19)
InChIKeyRUKGAEBDYJRKAX-UHFFFAOYSA-N
MW275.35 g/mol
LogP0.50
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide

N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide (PubChem CID 119323255) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide
PubChem CID119323255
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide
SMILESNC(=O)CN(Cc1ccccc1)C(=O)C1CCCNC1
InChIInChI=1S/C15H21N3O2/c16-14(19)11-18(10-12-5-2-1-3-6-12)15(20)13-7-4-8-17-9-13/h1-3,5-6,13,17H,4,7-11H2,(H2,16,19)
InChIKeyRUKGAEBDYJRKAX-UHFFFAOYSA-N
XLogP0.50
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dibenzylpiperidine-3-carboxamide;hydrochloride
CID 119261732
(3S)-N-(3-amino-3-oxopropyl)-N-benzylpiperidine-3-carboxamide
CID 81125382
(3S)-N-benzyl-N-propylpiperidine-3-carboxamide
CID 81123216
N-benzyl-N-propylpiperidine-3-carboxamide
CID 43588657
(3S)-N-benzyl-N-[2-(dimethylamino)ethyl]piperidine-3-carboxamide
CID 81126278
3-amino-N-(2-amino-2-oxoethyl)-N-benzylcyclopentane-1-carboxamide
CID 119783021
N,N-dibenzylcyclohexanecarboxamide
CID 1371794
N-benzyl-N-(cyanomethyl)pyrrolidine-3-carboxamide
CID 63005731
N-ethyl-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 54873767
N-(2-amino-2-oxoethyl)-N-benzyl-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119783040
N-benzyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
CID 63007100
benzyl-[[(3R)-piperidin-3-yl]methyl]carbamic acid;hydrochloride
CID 67098710

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide (CID 119323255) is N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide is NC(=O)CN(Cc1ccccc1)C(=O)C1CCCNC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide?
The InChIKey is RUKGAEBDYJRKAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c16-14(19)11-18(10-12-5-2-1-3-6-12)15(20)13-7-4-8-17-9-13/h1-3,5-6,13,17H,4,7-11H2,(H2,16,19).
What are the key properties of N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide?
N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide is sourced from PubChem (CID 119323255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).