N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide

C16H23N3O3 — CID 119305288

IUPACN-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide
SMILESCCOc1ccc(NC(=O)CNC(=O)C2CCCCN2)cc1
InChIInChI=1S/C16H23N3O3/c1-2-22-13-8-6-12(7-9-13)19-15(20)11-18-16(21)14-5-3-4-10-17-14/h6-9,14,17H,2-5,10-11H2,1H3,(H,18,21)(H,19,20)
InChIKeyDNECQFOIHPRVCJ-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.28
Rot. Bonds6

About N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide

N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide (PubChem CID 119305288) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide
PubChem CID119305288
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC NameN-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide
SMILESCCOc1ccc(NC(=O)CNC(=O)C2CCCCN2)cc1
InChIInChI=1S/C16H23N3O3/c1-2-22-13-8-6-12(7-9-13)19-15(20)11-18-16(21)14-5-3-4-10-17-14/h6-9,14,17H,2-5,10-11H2,1H3,(H,18,21)(H,19,20)
InChIKeyDNECQFOIHPRVCJ-UHFFFAOYSA-N
XLogP1.28
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 ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-chloroanilino)-2-oxoethyl]piperidine-2-carboxamide;hydrochloride
CID 119302426
2-[4-[[(2R)-piperidine-2-carbonyl]amino]phenoxy]acetic acid
CID 104913965
2-(cyclopentylamino)-N-(4-ethoxyphenyl)acetamide
CID 47107212
N-[4-(2-methoxyethoxy)phenyl]piperidine-2-carboxamide
CID 43713427
(1S)-N-[2-(4-ethoxyanilino)-2-oxoethyl]cyclohex-3-ene-1-carboxamide
CID 94811299
N-[2-(3-ethylanilino)-2-oxoethyl]piperidine-2-carboxamide;hydrochloride
CID 119312039
N-[2-(4-methylphenoxy)ethyl]piperidine-2-carboxamide
CID 119266821
N-(4-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670724
N-[2-(4-bromo-3-methylanilino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 119312487
(2R)-N-[4-[2-(dimethylamino)ethoxy]phenyl]piperidine-2-carboxamide
CID 103813549
2-[4-[[(2R)-pyrrolidine-2-carbonyl]amino]phenoxy]acetic acid
CID 104901157
N-[4-(2-amino-2-oxoethoxy)phenyl]azepane-2-carboxamide
CID 64564189

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide?
The IUPAC name of N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide (CID 119305288) is N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide?
The canonical SMILES for N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide is CCOc1ccc(NC(=O)CNC(=O)C2CCCCN2)cc1.
What is the InChIKey of N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide?
The InChIKey is DNECQFOIHPRVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-2-22-13-8-6-12(7-9-13)19-15(20)11-18-16(21)14-5-3-4-10-17-14/h6-9,14,17H,2-5,10-11H2,1H3,(H,18,21)(H,19,20).
What are the key properties of N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide?
N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 1.28, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethoxyanilino)-2-oxoethyl]piperidine-2-carboxamide is sourced from PubChem (CID 119305288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).