(3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol

C10H19NO — CID 126576100

IUPAC(3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol
SMILESC=C1C[C@@H](O)CN1C(CC)CC
InChIInChI=1S/C10H19NO/c1-4-9(5-2)11-7-10(12)6-8(11)3/h9-10,12H,3-7H2,1-2H3/t10-/m1/s1
InChIKeyIUIGSQDGKWQIKO-SNVBAGLBSA-N
MW169.27 g/mol
LogP1.76
Rot. Bonds3

About (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol

(3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol (PubChem CID 126576100) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol.

Molecular Properties

Compound Name(3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol
PubChem CID126576100
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol
SMILESC=C1C[C@@H](O)CN1C(CC)CC
InChIInChI=1S/C10H19NO/c1-4-9(5-2)11-7-10(12)6-8(11)3/h9-10,12H,3-7H2,1-2H3/t10-/m1/s1
InChIKeyIUIGSQDGKWQIKO-SNVBAGLBSA-N
XLogP1.76
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol?
The IUPAC name of (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol (CID 126576100) is (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol.
What is the SMILES notation for (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol?
The canonical SMILES for (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol is C=C1C[C@@H](O)CN1C(CC)CC.
What is the InChIKey of (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol?
The InChIKey is IUIGSQDGKWQIKO-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-9(5-2)11-7-10(12)6-8(11)3/h9-10,12H,3-7H2,1-2H3/t10-/m1/s1.
What are the key properties of (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol?
(3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol has a molecular weight of 169.27 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5-methylidene-1-pentan-3-ylpyrrolidin-3-ol is sourced from PubChem (CID 126576100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).