(1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine

C11H24N2 — CID 155184234

IUPAC(1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine
SMILESCC1(C)CN(C(C)(C)C)CC1CN
InChIInChI=1S/C11H24N2/c1-10(2,3)13-7-9(6-12)11(4,5)8-13/h9H,6-8,12H2,1-5H3
InChIKeyGDDLUCHLVZQJFI-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.70
Rot. Bonds1

About (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine

(1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine (PubChem CID 155184234) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine.

Molecular Properties

Compound Name(1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine
PubChem CID155184234
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name(1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine
SMILESCC1(C)CN(C(C)(C)C)CC1CN
InChIInChI=1S/C11H24N2/c1-10(2,3)13-7-9(6-12)11(4,5)8-13/h9H,6-8,12H2,1-5H3
InChIKeyGDDLUCHLVZQJFI-UHFFFAOYSA-N
XLogP1.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-tert-butyl-4,4-dimethylpiperidin-3-yl)methanamine
CID 117025757
1,4-ditert-butyl-3,3-dimethylpyrrolidine
CID 170668415
(7-tert-butyl-2-oxa-7-azaspiro[3.4]octan-5-yl)methanol
CID 176847731
(1R,5S,6R)-3,6-ditert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane
CID 167383396
(3aS,6aR)-5-tert-butyl-2,3a-dimethyl-3,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 152807256
(3aR,6aS)-5-tert-butyl-2,3a-dimethyl-3,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 131971707
1-tert-butyl-3,3-dimethylazetidine
CID 14090352
(3aS,6aR)-5-tert-butyl-2-ethyl-3a-methyl-3,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 167645455
5-tert-butyl-3a-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 176600869
1-tert-butylpyrrolidine-3,4-diamine
CID 89335821
(1-tert-butylazepan-3-yl)methanamine
CID 84659780
2-[4-(aminomethyl)-3,3-dimethylpiperidin-1-yl]-N,N-dimethylethanamine
CID 117024844

Frequently Asked Questions

What is the IUPAC name of (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine?
The IUPAC name of (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine (CID 155184234) is (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine.
What is the SMILES notation for (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine?
The canonical SMILES for (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine is CC1(C)CN(C(C)(C)C)CC1CN.
What is the InChIKey of (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine?
The InChIKey is GDDLUCHLVZQJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-10(2,3)13-7-9(6-12)11(4,5)8-13/h9H,6-8,12H2,1-5H3.
What are the key properties of (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine?
(1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine has a molecular weight of 184.33 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-tert-butyl-4,4-dimethylpyrrolidin-3-yl)methanamine is sourced from PubChem (CID 155184234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).