(1-propylpyrrolidin-2-yl)methanol

C8H17NO — CID 23383549

IUPAC(1-propylpyrrolidin-2-yl)methanol
SMILESCCCN1CCCC1CO
InChIInChI=1S/C8H17NO/c1-2-5-9-6-3-4-8(9)7-10/h8,10H,2-7H2,1H3
InChIKeyGDIQPZRESMPKNH-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.85
Rot. Bonds3

About (1-propylpyrrolidin-2-yl)methanol

(1-propylpyrrolidin-2-yl)methanol (PubChem CID 23383549) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (1-propylpyrrolidin-2-yl)methanol.

Molecular Properties

Compound Name(1-propylpyrrolidin-2-yl)methanol
PubChem CID23383549
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(1-propylpyrrolidin-2-yl)methanol
SMILESCCCN1CCCC1CO
InChIInChI=1S/C8H17NO/c1-2-5-9-6-3-4-8(9)7-10/h8,10H,2-7H2,1H3
InChIKeyGDIQPZRESMPKNH-UHFFFAOYSA-N
XLogP0.85
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-propylpyrrolidin-2-yl)methanol?
The IUPAC name of (1-propylpyrrolidin-2-yl)methanol (CID 23383549) is (1-propylpyrrolidin-2-yl)methanol.
What is the SMILES notation for (1-propylpyrrolidin-2-yl)methanol?
The canonical SMILES for (1-propylpyrrolidin-2-yl)methanol is CCCN1CCCC1CO.
What is the InChIKey of (1-propylpyrrolidin-2-yl)methanol?
The InChIKey is GDIQPZRESMPKNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-2-5-9-6-3-4-8(9)7-10/h8,10H,2-7H2,1H3.
What are the key properties of (1-propylpyrrolidin-2-yl)methanol?
(1-propylpyrrolidin-2-yl)methanol has a molecular weight of 143.23 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-propylpyrrolidin-2-yl)methanol is sourced from PubChem (CID 23383549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).