5-ethyl-1-propylpyrrolidin-3-ol

C9H19NO — CID 102568661

IUPAC5-ethyl-1-propylpyrrolidin-3-ol
SMILESCCCN1CC(O)CC1CC
InChIInChI=1S/C9H19NO/c1-3-5-10-7-9(11)6-8(10)4-2/h8-9,11H,3-7H2,1-2H3
InChIKeyONMLSBDCPSJENK-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.24
Rot. Bonds3

About 5-ethyl-1-propylpyrrolidin-3-ol

5-ethyl-1-propylpyrrolidin-3-ol (PubChem CID 102568661) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 5-ethyl-1-propylpyrrolidin-3-ol.

Molecular Properties

Compound Name5-ethyl-1-propylpyrrolidin-3-ol
PubChem CID102568661
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name5-ethyl-1-propylpyrrolidin-3-ol
SMILESCCCN1CC(O)CC1CC
InChIInChI=1S/C9H19NO/c1-3-5-10-7-9(11)6-8(10)4-2/h8-9,11H,3-7H2,1-2H3
InChIKeyONMLSBDCPSJENK-UHFFFAOYSA-N
XLogP1.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,5R)-1,5-dibutylpyrrolidin-3-ol
CID 99995389
(3R,5S)-1-hexadecyl-5-(hydroxymethyl)pyrrolidin-3-ol
CID 156737514
(3S,5S)-5-butyl-1-(2-fluoroethyl)pyrrolidin-3-ol
CID 99995475
(3S,5R)-1-butyl-5-(2-methylpropyl)pyrrolidin-3-ol
CID 124744564
1-(2-methoxyethyl)-5-propylpyrrolidin-3-ol
CID 102568675
(3R,5R)-1-amino-5-ethylpyrrolidin-3-ol
CID 166010699
(3S,5R)-5-butyl-1-(2-methoxyethyl)pyrrolidin-3-ol
CID 99995450
(3S,5S)-1-(2-methylpropyl)-5-propylpyrrolidin-3-ol
CID 99995289
(3R,5R)-1-(2-fluoroethyl)-5-(2-methylpropyl)pyrrolidin-3-ol
CID 99995622
1,4-dimethylpiperazine;(3R,5R)-5-ethyl-1-methylpyrrolidin-3-ol;tris(1-methylpiperidine);1-methylpyrrolidine
CID 160662524
1-ethyl-5-(2-methylpropyl)pyrrolidin-3-ol
CID 102568698
5-[(dimethylamino)methyl]-1-(2-pyrazol-1-ylethyl)pyrrolidin-3-ol
CID 66053792

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-propylpyrrolidin-3-ol?
The IUPAC name of 5-ethyl-1-propylpyrrolidin-3-ol (CID 102568661) is 5-ethyl-1-propylpyrrolidin-3-ol.
What is the SMILES notation for 5-ethyl-1-propylpyrrolidin-3-ol?
The canonical SMILES for 5-ethyl-1-propylpyrrolidin-3-ol is CCCN1CC(O)CC1CC.
What is the InChIKey of 5-ethyl-1-propylpyrrolidin-3-ol?
The InChIKey is ONMLSBDCPSJENK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-5-10-7-9(11)6-8(10)4-2/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 5-ethyl-1-propylpyrrolidin-3-ol?
5-ethyl-1-propylpyrrolidin-3-ol has a molecular weight of 157.26 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-propylpyrrolidin-3-ol is sourced from PubChem (CID 102568661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).