2,2-dimethyl-4-propan-2-ylpyrrolidine

C9H19N — CID 117269783

IUPAC2,2-dimethyl-4-propan-2-ylpyrrolidine
SMILESCC(C)C1CNC(C)(C)C1
InChIInChI=1S/C9H19N/c1-7(2)8-5-9(3,4)10-6-8/h7-8,10H,5-6H2,1-4H3
InChIKeyCUMNGLZUNTVCTC-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.03
Rot. Bonds1

About 2,2-dimethyl-4-propan-2-ylpyrrolidine

2,2-dimethyl-4-propan-2-ylpyrrolidine (PubChem CID 117269783) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 2,2-dimethyl-4-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name2,2-dimethyl-4-propan-2-ylpyrrolidine
PubChem CID117269783
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name2,2-dimethyl-4-propan-2-ylpyrrolidine
SMILESCC(C)C1CNC(C)(C)C1
InChIInChI=1S/C9H19N/c1-7(2)8-5-9(3,4)10-6-8/h7-8,10H,5-6H2,1-4H3
InChIKeyCUMNGLZUNTVCTC-UHFFFAOYSA-N
XLogP2.03
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5R)-2,2-dimethyl-5-propan-2-ylpiperidine
CID 139339152
2,2-difluoro-4-propan-2-ylpyrrolidine
CID 137391619
7-propan-2-yl-5-azaspiro[2.5]octane
CID 118287950
5,5-dimethyl-N-(2-methylpropyl)-N-propan-2-ylpyrrolidin-3-amine
CID 82013364
methane;1,2,2,6,6-pentamethyl-4-propan-2-ylpiperidine;2,2,6,6-tetramethyl-4-propan-2-ylpiperidine
CID 157477069
(2S,7R,9R,14R)-2,5,5,7,9,12,12,14-octamethyl-1,4,8,11-tetrazacyclotetradecane
CID 139079648
6-propan-2-yl-1-azaspiro[3.3]heptane
CID 103565323
1,1,2,3,3-pentamethyl-5-propan-2-ylcyclohexane
CID 140583880
(2S)-1,5,5-trimethyl-2-propan-2-ylpiperazine
CID 94982663
4-ethenyl-2,2-dimethylpyrrolidine
CID 145126401
(3S)-5,5-dimethylpyrrolidine-3-carbaldehyde
CID 141296159
2,2-diethyl-5-propan-2-ylpiperazine
CID 64884451

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-4-propan-2-ylpyrrolidine?
The IUPAC name of 2,2-dimethyl-4-propan-2-ylpyrrolidine (CID 117269783) is 2,2-dimethyl-4-propan-2-ylpyrrolidine.
What is the SMILES notation for 2,2-dimethyl-4-propan-2-ylpyrrolidine?
The canonical SMILES for 2,2-dimethyl-4-propan-2-ylpyrrolidine is CC(C)C1CNC(C)(C)C1.
What is the InChIKey of 2,2-dimethyl-4-propan-2-ylpyrrolidine?
The InChIKey is CUMNGLZUNTVCTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-7(2)8-5-9(3,4)10-6-8/h7-8,10H,5-6H2,1-4H3.
What are the key properties of 2,2-dimethyl-4-propan-2-ylpyrrolidine?
2,2-dimethyl-4-propan-2-ylpyrrolidine has a molecular weight of 141.26 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-4-propan-2-ylpyrrolidine is sourced from PubChem (CID 117269783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).