4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide

C14H28N2O2 — CID 106147963

IUPAC4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC(C)(C)CCO)C1
InChIInChI=1S/C14H28N2O2/c1-4-11-5-7-15-12(9-11)13(18)16-10-14(2,3)6-8-17/h11-12,15,17H,4-10H2,1-3H3,(H,16,18)
InChIKeyTYOSVDQTUZFTHP-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.29
Rot. Bonds6

About 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide

4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide (PubChem CID 106147963) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide
PubChem CID106147963
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC(C)(C)CCO)C1
InChIInChI=1S/C14H28N2O2/c1-4-11-5-7-15-12(9-11)13(18)16-10-14(2,3)6-8-17/h11-12,15,17H,4-10H2,1-3H3,(H,16,18)
InChIKeyTYOSVDQTUZFTHP-UHFFFAOYSA-N
XLogP1.29
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide
CID 106147826
4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
CID 106841954
4-ethyl-N-(2-methyl-2-phenylpropyl)piperidine-2-carboxamide
CID 114428574
N-(2,2-dimethylbutyl)-4-methylpiperidine-2-carboxamide
CID 103461667
N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
CID 114428046
4-ethyl-N-[2-(ethylamino)-2-oxoethyl]piperidine-2-carboxamide
CID 114428095
3-[(4-ethylpiperidine-2-carbonyl)amino]-3-methylbutanoic acid
CID 114429130
4-(2-cyclopropylethyl)-N-ethylpiperidine-2-carboxamide
CID 106779884
4-ethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
CID 114429484
4-[(4-ethylpiperidine-2-carbonyl)amino]-4-methylpentanoic acid
CID 114428891
4-ethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidine-2-carboxamide
CID 114429060

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide (CID 106147963) is 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide is CCC1CCNC(C(=O)NCC(C)(C)CCO)C1.
What is the InChIKey of 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide?
The InChIKey is TYOSVDQTUZFTHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-4-11-5-7-15-12(9-11)13(18)16-10-14(2,3)6-8-17/h11-12,15,17H,4-10H2,1-3H3,(H,16,18).
What are the key properties of 4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide?
4-ethyl-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide has a molecular weight of 256.39 g/mol, XLogP of 1.29, 6 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-2,2-dimethylbutyl)piperidine-2-carboxamide is sourced from PubChem (CID 106147963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).