4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide

C13H26N2O2 — CID 114429550

IUPAC4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NC(C)C(C)CO)C1
InChIInChI=1S/C13H26N2O2/c1-4-11-5-6-14-12(7-11)13(17)15-10(3)9(2)8-16/h9-12,14,16H,4-8H2,1-3H3,(H,15,17)
InChIKeySADRMPUVHXLMOG-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.90
Rot. Bonds5

About 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide

4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide (PubChem CID 114429550) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide
PubChem CID114429550
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NC(C)C(C)CO)C1
InChIInChI=1S/C13H26N2O2/c1-4-11-5-6-14-12(7-11)13(17)15-10(3)9(2)8-16/h9-12,14,16H,4-8H2,1-3H3,(H,15,17)
InChIKeySADRMPUVHXLMOG-UHFFFAOYSA-N
XLogP0.90
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-(3-methylbutan-2-yl)piperidine-2-carboxamide
CID 114428012
4-ethyl-N-(1-hydroxybutan-2-yl)piperidine-2-carboxamide
CID 114428056
4-ethyl-N-(1-methoxypropan-2-yl)piperidine-2-carboxamide
CID 114427831
(2S)-2-[(4-ethylpiperidine-2-carbonyl)amino]butanoic acid
CID 104921968
N-(1,3-dihydroxypropan-2-yl)-4-[(2S)-2-methylbutyl]piperidine-2-carboxamide
CID 163850863
4-ethyl-N-propan-2-ylsulfonylpiperidine-2-carboxamide
CID 103307962
4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide
CID 114428064
N-(1,3-dihydroxybutan-2-yl)-4-(2-methylbutyl)piperidine-2-carboxamide
CID 123499970
4-ethyl-N-(1-phenylethyl)piperidine-2-carboxamide
CID 114427805
(2S)-2-[(4-ethylpiperidine-2-carbonyl)amino]-4-methoxy-4-oxobutanoic acid
CID 104921912
4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
CID 106841954

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide (CID 114429550) is 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide is CCC1CCNC(C(=O)NC(C)C(C)CO)C1.
What is the InChIKey of 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide?
The InChIKey is SADRMPUVHXLMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-4-11-5-6-14-12(7-11)13(17)15-10(3)9(2)8-16/h9-12,14,16H,4-8H2,1-3H3,(H,15,17).
What are the key properties of 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide?
4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide has a molecular weight of 242.36 g/mol, XLogP of 0.90, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(4-hydroxy-3-methylbutan-2-yl)piperidine-2-carboxamide is sourced from PubChem (CID 114429550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).