(2-ethylpyrrolidin-2-yl)methanol

C7H15NO — CID 51072279

IUPAC(2-ethylpyrrolidin-2-yl)methanol
SMILESCCC1(CO)CCCN1
InChIInChI=1S/C7H15NO/c1-2-7(6-9)4-3-5-8-7/h8-9H,2-6H2,1H3
InChIKeyMUDJTIDXZWKQJP-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.51
Rot. Bonds2

About (2-ethylpyrrolidin-2-yl)methanol

(2-ethylpyrrolidin-2-yl)methanol (PubChem CID 51072279) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (2-ethylpyrrolidin-2-yl)methanol.

Molecular Properties

Compound Name(2-ethylpyrrolidin-2-yl)methanol
PubChem CID51072279
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(2-ethylpyrrolidin-2-yl)methanol
SMILESCCC1(CO)CCCN1
InChIInChI=1S/C7H15NO/c1-2-7(6-9)4-3-5-8-7/h8-9H,2-6H2,1H3
InChIKeyMUDJTIDXZWKQJP-UHFFFAOYSA-N
XLogP0.51
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-ethylpyrrolidin-2-yl)methanol?
The IUPAC name of (2-ethylpyrrolidin-2-yl)methanol (CID 51072279) is (2-ethylpyrrolidin-2-yl)methanol.
What is the SMILES notation for (2-ethylpyrrolidin-2-yl)methanol?
The canonical SMILES for (2-ethylpyrrolidin-2-yl)methanol is CCC1(CO)CCCN1.
What is the InChIKey of (2-ethylpyrrolidin-2-yl)methanol?
The InChIKey is MUDJTIDXZWKQJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-2-7(6-9)4-3-5-8-7/h8-9H,2-6H2,1H3.
What are the key properties of (2-ethylpyrrolidin-2-yl)methanol?
(2-ethylpyrrolidin-2-yl)methanol has a molecular weight of 129.20 g/mol, XLogP of 0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpyrrolidin-2-yl)methanol is sourced from PubChem (CID 51072279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).