1-methyl-3-(2-methylbutan-2-yl)pyrrolidine

C10H21N — CID 129106499

IUPAC1-methyl-3-(2-methylbutan-2-yl)pyrrolidine
SMILESCCC(C)(C)C1CCN(C)C1
InChIInChI=1S/C10H21N/c1-5-10(2,3)9-6-7-11(4)8-9/h9H,5-8H2,1-4H3
InChIKeyNETWXSLMHXAYOV-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.37
Rot. Bonds2

About 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine

1-methyl-3-(2-methylbutan-2-yl)pyrrolidine (PubChem CID 129106499) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine.

Molecular Properties

Compound Name1-methyl-3-(2-methylbutan-2-yl)pyrrolidine
PubChem CID129106499
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name1-methyl-3-(2-methylbutan-2-yl)pyrrolidine
SMILESCCC(C)(C)C1CCN(C)C1
InChIInChI=1S/C10H21N/c1-5-10(2,3)9-6-7-11(4)8-9/h9H,5-8H2,1-4H3
InChIKeyNETWXSLMHXAYOV-UHFFFAOYSA-N
XLogP2.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3R)-3-tert-butyl-1-methylpyrrolidine
CID 58837566
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ethane;2-(1-methylpyrrolidin-3-yl)propan-2-ol
CID 166075678
2-[(3R)-1-methylpyrrolidin-3-yl]propan-2-amine
CID 59033358
3-[5-(3,3-difluorocyclobutyl)-2,5-dimethylhexan-2-yl]-1-methylpyrrolidine
CID 139475194
1-methyl-3-(5-methylnonan-5-yl)pyrrolidine
CID 170333732
2-[[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]amino]acetaldehyde
CID 115223620
N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide
CID 115191509
2-methyl-2-(1-methylpiperidin-3-yl)propane-1-thiol
CID 116866531
3-[[[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]amino]methyl]cyclobutan-1-amine
CID 115214441
2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide
CID 115140342
4-(2-methylbutan-2-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohexan-1-amine
CID 115653405

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine?
The IUPAC name of 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine (CID 129106499) is 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine.
What is the SMILES notation for 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine?
The canonical SMILES for 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine is CCC(C)(C)C1CCN(C)C1.
What is the InChIKey of 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine?
The InChIKey is NETWXSLMHXAYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-5-10(2,3)9-6-7-11(4)8-9/h9H,5-8H2,1-4H3.
What are the key properties of 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine?
1-methyl-3-(2-methylbutan-2-yl)pyrrolidine has a molecular weight of 155.28 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-methylbutan-2-yl)pyrrolidine is sourced from PubChem (CID 129106499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).