1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine

C15H25N3 — CID 134595807

IUPAC1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine
SMILESCN(C)C1CCN(c2ccc(C(C)(C)C)nc2)C1
InChIInChI=1S/C15H25N3/c1-15(2,3)14-7-6-12(10-16-14)18-9-8-13(11-18)17(4)5/h6-7,10,13H,8-9,11H2,1-5H3
InChIKeyJLXJGUJXUOLSEF-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.52
Rot. Bonds2

About 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine

1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine (PubChem CID 134595807) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine
PubChem CID134595807
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine
SMILESCN(C)C1CCN(c2ccc(C(C)(C)C)nc2)C1
InChIInChI=1S/C15H25N3/c1-15(2,3)14-7-6-12(10-16-14)18-9-8-13(11-18)17(4)5/h6-7,10,13H,8-9,11H2,1-5H3
InChIKeyJLXJGUJXUOLSEF-UHFFFAOYSA-N
XLogP2.52
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-(6-tert-butyl-3-pyridinyl)pyrrolidin-3-ol
CID 171604045
3-(6-tert-butyl-3-pyridinyl)-8-oxa-3-azabicyclo[3.2.1]octane
CID 155245209
1-[6-(1-aminoethyl)-3-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
CID 83127619
(3R,5S)-1-(6-tert-butyl-3-pyridinyl)-3,5-dimethylpiperazine
CID 135253699
1-(6-tert-butylpyridazin-3-yl)-N,N-dimethylpiperidin-3-amine
CID 134595806
N,2,2-trimethyl-N-[1-[6-(trifluoromethyl)-3-pyridinyl]piperidin-4-yl]propanamide
CID 171326504
5-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carboxylic acid
CID 115490992
N,2,2-trimethyl-N-[1-[6-(trifluoromethyl)-3-pyridinyl]piperidin-3-yl]propanamide
CID 163350178
N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-amine
CID 153422507
1-[6-[(1R)-1-aminoethyl]-3-pyridinyl]-N,N-dimethylpiperidin-3-amine
CID 83126913
1-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-N,N-dimethylpiperidin-3-amine
CID 83127877
[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]methanol
CID 63164119

Frequently Asked Questions

What is the IUPAC name of 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine (CID 134595807) is 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine is CN(C)C1CCN(c2ccc(C(C)(C)C)nc2)C1.
What is the InChIKey of 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine?
The InChIKey is JLXJGUJXUOLSEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-15(2,3)14-7-6-12(10-16-14)18-9-8-13(11-18)17(4)5/h6-7,10,13H,8-9,11H2,1-5H3.
What are the key properties of 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine?
1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine has a molecular weight of 247.39 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-tert-butyl-3-pyridinyl)-N,N-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 134595807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).