[2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine

C12H24N2 — CID 130952102

IUPAC[2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine
SMILESCC1CN(C2CCC2CN)C(C)C1C
InChIInChI=1S/C12H24N2/c1-8-7-14(10(3)9(8)2)12-5-4-11(12)6-13/h8-12H,4-7,13H2,1-3H3
InChIKeyCASQGYWJJSQOJW-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.70
Rot. Bonds2

About [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine

[2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine (PubChem CID 130952102) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine
PubChem CID130952102
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name[2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine
SMILESCC1CN(C2CCC2CN)C(C)C1C
InChIInChI=1S/C12H24N2/c1-8-7-14(10(3)9(8)2)12-5-4-11(12)6-13/h8-12H,4-7,13H2,1-3H3
InChIKeyCASQGYWJJSQOJW-UHFFFAOYSA-N
XLogP1.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2,3,5-trimethylpiperidin-1-yl)cyclohexyl]methanamine
CID 114592320
[4-ethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexyl]methanamine
CID 114592315
[(1S)-2,3-dimethylcyclopentyl]methanamine
CID 129279891
[2-(2-methylazetidin-1-yl)cyclohexyl]methanamine
CID 79677584
[2-(2-methylmorpholin-4-yl)cyclobutyl]methanamine
CID 80998199
[4-tert-butyl-2-(2,3-dimethylpiperidin-1-yl)cyclohexyl]methanamine
CID 63404551
[2-[(3,4-dimethylpyrrolidin-1-yl)methyl]cyclohexyl]methanamine
CID 79181049
(1,3-dimethylpiperidin-4-yl)methanamine
CID 55285263
[2-(3-methoxypyrrolidin-1-yl)cyclobutyl]methanamine
CID 103539662
[1-[2-(aminomethyl)cycloheptyl]-3-methylpyrrolidin-2-yl]methanol
CID 102778150
[2-(4-propan-2-ylpiperidin-1-yl)cyclobutyl]methanamine
CID 103503245
[2-(3-methylazetidin-1-yl)cycloheptyl]methanamine
CID 164661715

Frequently Asked Questions

What is the IUPAC name of [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine?
The IUPAC name of [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine (CID 130952102) is [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine.
What is the SMILES notation for [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine?
The canonical SMILES for [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine is CC1CN(C2CCC2CN)C(C)C1C.
What is the InChIKey of [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine?
The InChIKey is CASQGYWJJSQOJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-8-7-14(10(3)9(8)2)12-5-4-11(12)6-13/h8-12H,4-7,13H2,1-3H3.
What are the key properties of [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine?
[2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine has a molecular weight of 196.34 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3,4-trimethylpyrrolidin-1-yl)cyclobutyl]methanamine is sourced from PubChem (CID 130952102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).