1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol

C14H30N2O — CID 114681950

IUPAC1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol
SMILESCCNC(C)C(C)(C)CN1CCC(O)C(C)C1
InChIInChI=1S/C14H30N2O/c1-6-15-12(3)14(4,5)10-16-8-7-13(17)11(2)9-16/h11-13,15,17H,6-10H2,1-5H3
InChIKeyRNDYPXXZEGURRH-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.71
Rot. Bonds5

About 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol

1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol (PubChem CID 114681950) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol
PubChem CID114681950
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol
SMILESCCNC(C)C(C)(C)CN1CCC(O)C(C)C1
InChIInChI=1S/C14H30N2O/c1-6-15-12(3)14(4,5)10-16-8-7-13(17)11(2)9-16/h11-13,15,17H,6-10H2,1-5H3
InChIKeyRNDYPXXZEGURRH-UHFFFAOYSA-N
XLogP1.71
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine
CID 66455139
(3S,4R)-1-ethyl-3-methylpiperidin-4-ol
CID 143448112
N-ethyl-3,3-dimethyl-4-(4-methylpiperazin-1-yl)butan-2-amine
CID 66453823
methyl 3-(4-hydroxy-3-methylpiperidin-1-yl)-2,2-dimethylpropanoate
CID 114502582
4-(2,3-dimethylpiperidin-1-yl)-N-ethyl-3,3-dimethylbutan-2-amine
CID 66455577
3-methyl-1-[2-methyl-2-(propylaminomethyl)butyl]piperidin-4-ol
CID 114681883
3,3-dimethyl-N-propyl-4-(4-propylpiperidin-1-yl)butan-2-amine
CID 66453199
1-(3-hydroxy-2,2-dimethylbutyl)-4-methylpyrrolidin-3-ol
CID 131026005
1-[2-ethyl-2-(propylaminomethyl)butyl]-3-methylpiperidin-4-ol
CID 114681903
3-methyl-1-[2-methyl-3-(methylamino)propyl]piperidin-4-ol
CID 114681091
N-(2-cyano-3-methylbutan-2-yl)-2-(4-hydroxy-3-methylpiperidin-1-yl)acetamide
CID 114681261
4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-3,3-dimethyl-N-propylbutan-2-amine
CID 79945323

Frequently Asked Questions

What is the IUPAC name of 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol?
The IUPAC name of 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol (CID 114681950) is 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol?
The canonical SMILES for 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol is CCNC(C)C(C)(C)CN1CCC(O)C(C)C1.
What is the InChIKey of 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol?
The InChIKey is RNDYPXXZEGURRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-6-15-12(3)14(4,5)10-16-8-7-13(17)11(2)9-16/h11-13,15,17H,6-10H2,1-5H3.
What are the key properties of 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol?
1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol has a molecular weight of 242.41 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol is sourced from PubChem (CID 114681950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).