4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide

C13H25N3O2 — CID 114428064

IUPAC4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC(=O)NC(C)C)C1
InChIInChI=1S/C13H25N3O2/c1-4-10-5-6-14-11(7-10)13(18)15-8-12(17)16-9(2)3/h9-11,14H,4-8H2,1-3H3,(H,15,18)(H,16,17)
InChIKeyTVFBLHNYMDYXDW-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.41
Rot. Bonds5

About 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide

4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide (PubChem CID 114428064) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide
PubChem CID114428064
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC(=O)NC(C)C)C1
InChIInChI=1S/C13H25N3O2/c1-4-10-5-6-14-11(7-10)13(18)15-8-12(17)16-9(2)3/h9-11,14H,4-8H2,1-3H3,(H,15,18)(H,16,17)
InChIKeyTVFBLHNYMDYXDW-UHFFFAOYSA-N
XLogP0.41
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-[2-(ethylamino)-2-oxoethyl]piperidine-2-carboxamide
CID 114428095
4-ethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
CID 114429484
4-ethyl-N-(3-methylbutan-2-yl)piperidine-2-carboxamide
CID 114428012
N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
CID 114428046
4-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrrolidine-2-carboxamide
CID 43515171
4-ethyl-N-(3-methyl-2-pyrrolidin-1-ylbutyl)piperidine-2-carboxamide
CID 114428726
4-ethyl-N-[[1-(2-methylpropyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 114429304
4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide
CID 114429550
4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 114428936
4-ethyl-N-propan-2-ylsulfonylpiperidine-2-carboxamide
CID 103307962
4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
4-ethyl-N-(3-ethyl-2-hydroxypentyl)piperidine-2-carboxamide
CID 106286595

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide (CID 114428064) is 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide is CCC1CCNC(C(=O)NCC(=O)NC(C)C)C1.
What is the InChIKey of 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide?
The InChIKey is TVFBLHNYMDYXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-4-10-5-6-14-11(7-10)13(18)15-8-12(17)16-9(2)3/h9-11,14H,4-8H2,1-3H3,(H,15,18)(H,16,17).
What are the key properties of 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide?
4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 0.41, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 114428064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).