N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide

C16H23N3O3 — CID 120624225

IUPACN-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NCC(=O)Nc2ccccc2)CCNCC1
InChIInChI=1S/C16H23N3O3/c1-22-12-16(7-9-17-10-8-16)15(21)18-11-14(20)19-13-5-3-2-4-6-13/h2-6,17H,7-12H2,1H3,(H,18,21)(H,19,20)
InChIKeyPQVNVZHEINZFCU-UHFFFAOYSA-N
MW305.38 g/mol
LogP0.76
Rot. Bonds6

About N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide

N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 120624225) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID120624225
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC NameN-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NCC(=O)Nc2ccccc2)CCNCC1
InChIInChI=1S/C16H23N3O3/c1-22-12-16(7-9-17-10-8-16)15(21)18-11-14(20)19-13-5-3-2-4-6-13/h2-6,17H,7-12H2,1H3,(H,18,21)(H,19,20)
InChIKeyPQVNVZHEINZFCU-UHFFFAOYSA-N
XLogP0.76
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-anilino-3-oxopropyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120632986
N-[2-(4-chloroanilino)-2-oxoethyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120625334
N-(4-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 120616741
4-(methoxymethyl)-N-[2-oxo-2-(4-pyrazol-1-ylanilino)ethyl]piperidine-4-carboxamide;hydrochloride
CID 120630144
4-(methoxymethyl)-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]piperidine-4-carboxamide;hydrochloride
CID 120630106
N-benzyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616012
N-(3-anilinophenyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120622758
4-(methoxymethyl)-N-(2-phenoxyethyl)piperidine-4-carboxamide;hydrochloride
CID 120617692
4-(methoxymethyl)-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide;hydrochloride
CID 120618108
4-(methoxymethyl)-N-(3-methylbut-2-enyl)piperidine-4-carboxamide
CID 106187178
4-(methoxymethyl)-N-[(4-phenyloxan-4-yl)methyl]piperidine-4-carboxamide;hydrochloride
CID 120623338
N-[2-(2,6-dimethylphenyl)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120633424

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide (CID 120624225) is N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide is COCC1(C(=O)NCC(=O)Nc2ccccc2)CCNCC1.
What is the InChIKey of N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is PQVNVZHEINZFCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-22-12-16(7-9-17-10-8-16)15(21)18-11-14(20)19-13-5-3-2-4-6-13/h2-6,17H,7-12H2,1H3,(H,18,21)(H,19,20).
What are the key properties of N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide?
N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 0.76, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxoethyl)-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 120624225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).