2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol

C12H26N2O — CID 106809047

IUPAC2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol
SMILESCCC(CO)(CCCN1CCCC1)NC
InChIInChI=1S/C12H26N2O/c1-3-12(11-15,13-2)7-6-10-14-8-4-5-9-14/h13,15H,3-11H2,1-2H3
InChIKeyRJIQJRVVTMPTBN-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.22
Rot. Bonds7

About 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol

2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol (PubChem CID 106809047) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol
PubChem CID106809047
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol
SMILESCCC(CO)(CCCN1CCCC1)NC
InChIInChI=1S/C12H26N2O/c1-3-12(11-15,13-2)7-6-10-14-8-4-5-9-14/h13,15H,3-11H2,1-2H3
InChIKeyRJIQJRVVTMPTBN-UHFFFAOYSA-N
XLogP1.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4,4-diethylpiperidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol
CID 106808882
2-ethyl-5-(4-ethylazepan-1-yl)-2-(methylamino)pentan-1-ol
CID 106809648
2-ethyl-2-(methylamino)-5-[4-(trifluoromethyl)piperidin-1-yl]pentan-1-ol
CID 106809681
2-ethyl-2-(methylamino)-5-(3,3,4-trimethylpiperazin-1-yl)pentan-1-ol
CID 106808752
2-ethyl-5-(3-ethyl-4-methylpiperazin-1-yl)-2-(methylamino)pentan-1-ol
CID 106808728
2-ethyl-5-[3-(methoxymethyl)piperidin-1-yl]-2-(methylamino)pentan-1-ol
CID 106809961
2-ethyl-5-(2-ethylazepan-1-yl)-2-(methylamino)pentan-1-ol
CID 106809858
2-ethyl-5-(4-methylpiperazin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809069
2-ethyl-2-(2-pyrrolidin-1-ylethylamino)propane-1,3-diol
CID 107912102
5-(2-cyclopentylpyrrolidin-1-yl)-2-ethyl-2-(methylamino)pentan-1-ol
CID 106809445
2-ethyl-2-(ethylamino)-5-(4-propan-2-ylpiperazin-1-yl)pentan-1-ol
CID 106809289
5-(2-azabicyclo[2.2.1]heptan-2-yl)-2-ethyl-2-(methylamino)pentan-1-ol
CID 106809483

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol?
The IUPAC name of 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol (CID 106809047) is 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol.
What is the SMILES notation for 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol?
The canonical SMILES for 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol is CCC(CO)(CCCN1CCCC1)NC.
What is the InChIKey of 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol?
The InChIKey is RJIQJRVVTMPTBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-3-12(11-15,13-2)7-6-10-14-8-4-5-9-14/h13,15H,3-11H2,1-2H3.
What are the key properties of 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol?
2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol has a molecular weight of 214.35 g/mol, XLogP of 1.22, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol is sourced from PubChem (CID 106809047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).