2,2-bis(2-methylpropyl)pyrrolidine

C12H25N — CID 66465846

IUPAC2,2-bis(2-methylpropyl)pyrrolidine
SMILESCC(C)CC1(CC(C)C)CCCN1
InChIInChI=1S/C12H25N/c1-10(2)8-12(9-11(3)4)6-5-7-13-12/h10-11,13H,5-9H2,1-4H3
InChIKeyFPMLAKUCGSKTMU-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.20
Rot. Bonds4

About 2,2-bis(2-methylpropyl)pyrrolidine

2,2-bis(2-methylpropyl)pyrrolidine (PubChem CID 66465846) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 2,2-bis(2-methylpropyl)pyrrolidine.

Molecular Properties

Compound Name2,2-bis(2-methylpropyl)pyrrolidine
PubChem CID66465846
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name2,2-bis(2-methylpropyl)pyrrolidine
SMILESCC(C)CC1(CC(C)C)CCCN1
InChIInChI=1S/C12H25N/c1-10(2)8-12(9-11(3)4)6-5-7-13-12/h10-11,13H,5-9H2,1-4H3
InChIKeyFPMLAKUCGSKTMU-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-bis(2-methylpropyl)pyrrolidine?
The IUPAC name of 2,2-bis(2-methylpropyl)pyrrolidine (CID 66465846) is 2,2-bis(2-methylpropyl)pyrrolidine.
What is the SMILES notation for 2,2-bis(2-methylpropyl)pyrrolidine?
The canonical SMILES for 2,2-bis(2-methylpropyl)pyrrolidine is CC(C)CC1(CC(C)C)CCCN1.
What is the InChIKey of 2,2-bis(2-methylpropyl)pyrrolidine?
The InChIKey is FPMLAKUCGSKTMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-10(2)8-12(9-11(3)4)6-5-7-13-12/h10-11,13H,5-9H2,1-4H3.
What are the key properties of 2,2-bis(2-methylpropyl)pyrrolidine?
2,2-bis(2-methylpropyl)pyrrolidine has a molecular weight of 183.34 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(2-methylpropyl)pyrrolidine is sourced from PubChem (CID 66465846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).