2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol

C16H34N2O — CID 106809851

IUPAC2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
SMILESCCC1CCN(CCCC(CC)(CO)NC(C)C)C1
InChIInChI=1S/C16H34N2O/c1-5-15-8-11-18(12-15)10-7-9-16(6-2,13-19)17-14(3)4/h14-15,17,19H,5-13H2,1-4H3
InChIKeyZDJDLIUWPSRJLZ-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.64
Rot. Bonds9

About 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol

2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol (PubChem CID 106809851) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol.

Molecular Properties

Compound Name2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
PubChem CID106809851
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
SMILESCCC1CCN(CCCC(CC)(CO)NC(C)C)C1
InChIInChI=1S/C16H34N2O/c1-5-15-8-11-18(12-15)10-7-9-16(6-2,13-19)17-14(3)4/h14-15,17,19H,5-13H2,1-4H3
InChIKeyZDJDLIUWPSRJLZ-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-5-(3-ethylpiperidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809284
2-ethyl-5-(3-methoxypyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809954
5-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-ethyl-2-(propan-2-ylamino)pentan-1-ol
CID 106809748
5-(3-ethylpiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64797909
2-ethyl-5-(4-methylpiperazin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809069
5-(3-ethylpyrrolidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 113418654
2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol
CID 106809852
2-ethyl-5-(4-ethylazepan-1-yl)-2-(methylamino)pentan-1-ol
CID 106809648
2-ethyl-5-(2-ethylpiperidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809193
2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol
CID 106809843
5-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-ethyl-2-(propan-2-ylamino)pentan-1-ol
CID 106809903
3-(3-ethylpyrrolidin-1-yl)propan-1-ol
CID 67281983

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol?
The IUPAC name of 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol (CID 106809851) is 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol.
What is the SMILES notation for 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol?
The canonical SMILES for 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol is CCC1CCN(CCCC(CC)(CO)NC(C)C)C1.
What is the InChIKey of 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol?
The InChIKey is ZDJDLIUWPSRJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-5-15-8-11-18(12-15)10-7-9-16(6-2,13-19)17-14(3)4/h14-15,17,19H,5-13H2,1-4H3.
What are the key properties of 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol?
2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol has a molecular weight of 270.46 g/mol, XLogP of 2.64, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol is sourced from PubChem (CID 106809851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).