N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide

C18H26N4O3 — CID 26653754

IUPACN-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide
SMILESCCNC(=O)NC(=O)CN1CCC(C(=O)NCc2ccccc2)CC1
InChIInChI=1S/C18H26N4O3/c1-2-19-18(25)21-16(23)13-22-10-8-15(9-11-22)17(24)20-12-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3,(H,20,24)(H2,19,21,23,25)
InChIKeyBDEFZRHJRVPQGB-UHFFFAOYSA-N
MW346.43 g/mol
LogP0.86
Rot. Bonds6

About N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide

N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide (PubChem CID 26653754) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide
PubChem CID26653754
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC NameN-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide
SMILESCCNC(=O)NC(=O)CN1CCC(C(=O)NCc2ccccc2)CC1
InChIInChI=1S/C18H26N4O3/c1-2-19-18(25)21-16(23)13-22-10-8-15(9-11-22)17(24)20-12-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3,(H,20,24)(H2,19,21,23,25)
InChIKeyBDEFZRHJRVPQGB-UHFFFAOYSA-N
XLogP0.86
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-1-[2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxoethyl]piperidine-4-carboxamide
CID 27107463
N-benzyl-1-[2-(butylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 27107050
1-[2-(benzylcarbamoylamino)-2-oxoethyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 37177808
1-[2-(benzylamino)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide
CID 52682822
N-benzyl-1-[2-(cyclohexylmethylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 86909124
1-benzyl-N-[[4-(ethylcarbamoyl)phenyl]methyl]piperidine-4-carboxamide
CID 136579023
N-benzyl-1-[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]piperidine-4-carboxamide
CID 41415384
N-benzyl-1-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 25468739
2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide
CID 26037570
N-[(4-fluorophenyl)methyl]-1-[2-(methylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 78902356
(3S,4R)-1-[2-(ethylamino)-2-oxoethyl]-4-hydroxy-N-[(4-phenylphenyl)methyl]piperidine-3-carboxamide
CID 170507621
N-benzyl-1-[2-(3-cyanoanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 25498632

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide?
The IUPAC name of N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide (CID 26653754) is N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide.
What is the SMILES notation for N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide?
The canonical SMILES for N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide is CCNC(=O)NC(=O)CN1CCC(C(=O)NCc2ccccc2)CC1.
What is the InChIKey of N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide?
The InChIKey is BDEFZRHJRVPQGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-2-19-18(25)21-16(23)13-22-10-8-15(9-11-22)17(24)20-12-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3,(H,20,24)(H2,19,21,23,25).
What are the key properties of N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide?
N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide has a molecular weight of 346.43 g/mol, XLogP of 0.86, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-[2-(ethylcarbamoylamino)-2-oxoethyl]piperidine-4-carboxamide is sourced from PubChem (CID 26653754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).