5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol

C17H36N2O — CID 106808882

IUPAC5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol
SMILESCCC1(CC)CCN(CCCC(CC)(CO)NC)CC1
InChIInChI=1S/C17H36N2O/c1-5-16(6-2)10-13-19(14-11-16)12-8-9-17(7-3,15-20)18-4/h18,20H,5-15H2,1-4H3
InChIKeyNUSSALBEARMKCV-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.03
Rot. Bonds9

About 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol

5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol (PubChem CID 106808882) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol.

Molecular Properties

Compound Name5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol
PubChem CID106808882
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC Name5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol
SMILESCCC1(CC)CCN(CCCC(CC)(CO)NC)CC1
InChIInChI=1S/C17H36N2O/c1-5-16(6-2)10-13-19(14-11-16)12-8-9-17(7-3,15-20)18-4/h18,20H,5-15H2,1-4H3
InChIKeyNUSSALBEARMKCV-UHFFFAOYSA-N
XLogP3.03
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol
CID 106809047
5-(3,3-diethylpyrrolidin-1-yl)-2-ethyl-2-(propan-2-ylamino)pentan-1-ol
CID 106809760
2-ethyl-2-(methylamino)-5-(3,3,4-trimethylpiperazin-1-yl)pentan-1-ol
CID 106808752
2-(cyclopropylamino)-5-(3,3-diethylpyrrolidin-1-yl)-2-ethylpentan-1-ol
CID 106809757
2-ethyl-2-(methylamino)-5-[4-(trifluoromethyl)piperidin-1-yl]pentan-1-ol
CID 106809681
2-ethyl-5-(3-ethyl-4-methylpiperazin-1-yl)-2-(methylamino)pentan-1-ol
CID 106808728
2-ethyl-5-(4-ethylazepan-1-yl)-2-(methylamino)pentan-1-ol
CID 106809648
2-ethyl-5-[3-(methoxymethyl)piperidin-1-yl]-2-(methylamino)pentan-1-ol
CID 106809961
4-(4,4-diethylpiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)butan-1-ol
CID 64790896
5-(4,4-diethylpiperidin-1-yl)-2,2-dimethylpentan-1-amine
CID 65254542
2-ethyl-5-(4-methylpiperazin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809069
5-(2-cyclopentylpyrrolidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol
CID 106809445

Frequently Asked Questions

What is the IUPAC name of 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol?
The IUPAC name of 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol (CID 106808882) is 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol.
What is the SMILES notation for 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol?
The canonical SMILES for 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol is CCC1(CC)CCN(CCCC(CC)(CO)NC)CC1.
What is the InChIKey of 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol?
The InChIKey is NUSSALBEARMKCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-5-16(6-2)10-13-19(14-11-16)12-8-9-17(7-3,15-20)18-4/h18,20H,5-15H2,1-4H3.
What are the key properties of 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol?
5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol has a molecular weight of 284.49 g/mol, XLogP of 3.03, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol is sourced from PubChem (CID 106808882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).