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

C13H28N2O — CID 106809852

IUPAC2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol
SMILESCCC1CCN(CCCC(N)(CC)CO)C1
InChIInChI=1S/C13H28N2O/c1-3-12-6-9-15(10-12)8-5-7-13(14,4-2)11-16/h12,16H,3-11,14H2,1-2H3
InChIKeyMGYXBDMQLQCJAL-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.60
Rot. Bonds7

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

2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol (PubChem CID 106809852) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol.

Molecular Properties

Compound Name2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol
PubChem CID106809852
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol
SMILESCCC1CCN(CCCC(N)(CC)CO)C1
InChIInChI=1S/C13H28N2O/c1-3-12-6-9-15(10-12)8-5-7-13(14,4-2)11-16/h12,16H,3-11,14H2,1-2H3
InChIKeyMGYXBDMQLQCJAL-UHFFFAOYSA-N
XLogP1.60
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-ethyl-5-(4-methylpiperidin-1-yl)pentan-1-ol
CID 106809046
3-(3-ethylpyrrolidin-1-yl)propan-1-ol
CID 67281983
2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809851
2-amino-2-ethyl-5-(4-methylpiperazin-1-yl)pentan-1-ol
CID 106809070
2-amino-2-ethyl-5-(2-methylmorpholin-4-yl)pentan-1-ol
CID 106809098
6-(3-ethylpyrrolidin-1-yl)hexan-1-ol
CID 103748114
2-ethyl-5-(3-ethylpiperidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809284
3-ethyl-1-heptylpyrrolidine;trifluoromethanesulfonic acid
CID 175849480
5-(3-ethylpiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64797909
2-(cyclopropylamino)-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentanenitrile
CID 106803966
2-amino-2-ethyl-5-(4-ethylpiperidin-1-yl)pentanenitrile
CID 106803381
5-(3-ethylpyrrolidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 113418654

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol?
The IUPAC name of 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol (CID 106809852) is 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol.
What is the SMILES notation for 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol?
The canonical SMILES for 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol is CCC1CCN(CCCC(N)(CC)CO)C1.
What is the InChIKey of 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol?
The InChIKey is MGYXBDMQLQCJAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-3-12-6-9-15(10-12)8-5-7-13(14,4-2)11-16/h12,16H,3-11,14H2,1-2H3.
What are the key properties of 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol?
2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol has a molecular weight of 228.38 g/mol, XLogP of 1.60, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-ethyl-5-(3-ethylpyrrolidin-1-yl)pentan-1-ol is sourced from PubChem (CID 106809852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).