1-butan-2-yl-2-cyclopropylpyrrolidine

C11H21N — CID 131083099

IUPAC1-butan-2-yl-2-cyclopropylpyrrolidine
SMILESCCC(C)N1CCCC1C1CC1
InChIInChI=1S/C11H21N/c1-3-9(2)12-8-4-5-11(12)10-6-7-10/h9-11H,3-8H2,1-2H3
InChIKeyBWOIQOOTGRSSJB-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.66
Rot. Bonds3

About 1-butan-2-yl-2-cyclopropylpyrrolidine

1-butan-2-yl-2-cyclopropylpyrrolidine (PubChem CID 131083099) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 1-butan-2-yl-2-cyclopropylpyrrolidine.

Molecular Properties

Compound Name1-butan-2-yl-2-cyclopropylpyrrolidine
PubChem CID131083099
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name1-butan-2-yl-2-cyclopropylpyrrolidine
SMILESCCC(C)N1CCCC1C1CC1
InChIInChI=1S/C11H21N/c1-3-9(2)12-8-4-5-11(12)10-6-7-10/h9-11H,3-8H2,1-2H3
InChIKeyBWOIQOOTGRSSJB-UHFFFAOYSA-N
XLogP2.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-2-cyclopropylpyrrolidine?
The IUPAC name of 1-butan-2-yl-2-cyclopropylpyrrolidine (CID 131083099) is 1-butan-2-yl-2-cyclopropylpyrrolidine.
What is the SMILES notation for 1-butan-2-yl-2-cyclopropylpyrrolidine?
The canonical SMILES for 1-butan-2-yl-2-cyclopropylpyrrolidine is CCC(C)N1CCCC1C1CC1.
What is the InChIKey of 1-butan-2-yl-2-cyclopropylpyrrolidine?
The InChIKey is BWOIQOOTGRSSJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-3-9(2)12-8-4-5-11(12)10-6-7-10/h9-11H,3-8H2,1-2H3.
What are the key properties of 1-butan-2-yl-2-cyclopropylpyrrolidine?
1-butan-2-yl-2-cyclopropylpyrrolidine has a molecular weight of 167.30 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-2-cyclopropylpyrrolidine is sourced from PubChem (CID 131083099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).