N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide

C16H23N3O3 — CID 119283903

IUPACN-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide
SMILESCCNC(=O)COc1ccc(NC(=O)C2CCCNC2)cc1
InChIInChI=1S/C16H23N3O3/c1-2-18-15(20)11-22-14-7-5-13(6-8-14)19-16(21)12-4-3-9-17-10-12/h5-8,12,17H,2-4,9-11H2,1H3,(H,18,20)(H,19,21)
InChIKeyZCYXHGIBZDLHRA-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.14
Rot. Bonds6

About N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide

N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide (PubChem CID 119283903) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide
PubChem CID119283903
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC NameN-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide
SMILESCCNC(=O)COc1ccc(NC(=O)C2CCCNC2)cc1
InChIInChI=1S/C16H23N3O3/c1-2-18-15(20)11-22-14-7-5-13(6-8-14)19-16(21)12-4-3-9-17-10-12/h5-8,12,17H,2-4,9-11H2,1H3,(H,18,20)(H,19,21)
InChIKeyZCYXHGIBZDLHRA-UHFFFAOYSA-N
XLogP1.14
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 ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[4-[[(3S)-piperidine-3-carbonyl]amino]phenoxy]acetate
CID 81118246
(2S,4S)-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120621065
1-butanoyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide
CID 55910927
(2R)-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]oxolane-2-carboxamide
CID 32936903
(3R)-N-[4-(diethylamino)phenyl]piperidine-3-carboxamide
CID 28807399
(3R)-N-[4-(difluoromethoxy)phenyl]piperidine-3-carboxamide
CID 81123871
N-[4-[(2-fluorophenyl)methoxy]phenyl]piperidine-3-carboxamide
CID 119311313
N-[4-[(4-phenylphenyl)methoxy]phenyl]piperidine-3-carboxamide
CID 25222866
N-[4-(propylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119297921
(3R)-N-[4-(dimethylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 81123557
N-[2-[4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]ethyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119751120
N-[4-(propylsulfonylamino)phenyl]piperidine-3-carboxamide
CID 119306484

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide?
The IUPAC name of N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide (CID 119283903) is N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide?
The canonical SMILES for N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide is CCNC(=O)COc1ccc(NC(=O)C2CCCNC2)cc1.
What is the InChIKey of N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide?
The InChIKey is ZCYXHGIBZDLHRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-2-18-15(20)11-22-14-7-5-13(6-8-14)19-16(21)12-4-3-9-17-10-12/h5-8,12,17H,2-4,9-11H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide?
N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 1.14, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 119283903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).