1-(4-methylpentan-2-yl)pyrrolidine

C10H21N — CID 59761841

IUPAC1-(4-methylpentan-2-yl)pyrrolidine
SMILESCC(C)CC(C)N1CCCC1
InChIInChI=1S/C10H21N/c1-9(2)8-10(3)11-6-4-5-7-11/h9-10H,4-8H2,1-3H3
InChIKeyYVWCOGZTADSVIV-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.52
Rot. Bonds3

About 1-(4-methylpentan-2-yl)pyrrolidine

1-(4-methylpentan-2-yl)pyrrolidine (PubChem CID 59761841) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 1-(4-methylpentan-2-yl)pyrrolidine.

Molecular Properties

Compound Name1-(4-methylpentan-2-yl)pyrrolidine
PubChem CID59761841
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name1-(4-methylpentan-2-yl)pyrrolidine
SMILESCC(C)CC(C)N1CCCC1
InChIInChI=1S/C10H21N/c1-9(2)8-10(3)11-6-4-5-7-11/h9-10H,4-8H2,1-3H3
InChIKeyYVWCOGZTADSVIV-UHFFFAOYSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpentan-2-yl)pyrrolidine?
The IUPAC name of 1-(4-methylpentan-2-yl)pyrrolidine (CID 59761841) is 1-(4-methylpentan-2-yl)pyrrolidine.
What is the SMILES notation for 1-(4-methylpentan-2-yl)pyrrolidine?
The canonical SMILES for 1-(4-methylpentan-2-yl)pyrrolidine is CC(C)CC(C)N1CCCC1.
What is the InChIKey of 1-(4-methylpentan-2-yl)pyrrolidine?
The InChIKey is YVWCOGZTADSVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-9(2)8-10(3)11-6-4-5-7-11/h9-10H,4-8H2,1-3H3.
What are the key properties of 1-(4-methylpentan-2-yl)pyrrolidine?
1-(4-methylpentan-2-yl)pyrrolidine has a molecular weight of 155.28 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpentan-2-yl)pyrrolidine is sourced from PubChem (CID 59761841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).