N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine

C12H19N3 — CID 107875130

IUPACN-(azetidin-3-yl)-5-tert-butylpyridin-2-amine
SMILESCC(C)(C)c1ccc(NC2CNC2)nc1
InChIInChI=1S/C12H19N3/c1-12(2,3)9-4-5-11(14-6-9)15-10-7-13-8-10/h4-6,10,13H,7-8H2,1-3H3,(H,14,15)
InChIKeyIXYYSWDCSGKFMU-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.76
Rot. Bonds2

About N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine

N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine (PubChem CID 107875130) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine.

Molecular Properties

Compound NameN-(azetidin-3-yl)-5-tert-butylpyridin-2-amine
PubChem CID107875130
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-(azetidin-3-yl)-5-tert-butylpyridin-2-amine
SMILESCC(C)(C)c1ccc(NC2CNC2)nc1
InChIInChI=1S/C12H19N3/c1-12(2,3)9-4-5-11(14-6-9)15-10-7-13-8-10/h4-6,10,13H,7-8H2,1-3H3,(H,14,15)
InChIKeyIXYYSWDCSGKFMU-UHFFFAOYSA-N
XLogP1.76
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(5-tert-butyl-2-pyridinyl)amino]cyclobutan-1-ol
CID 107874766
4-N-(5-tert-butyl-2-pyridinyl)cyclohexane-1,4-diamine
CID 114011527
5-tert-butyl-N-(1-ethylpiperidin-4-yl)pyridin-2-amine
CID 107874539
N-(azetidin-3-yl)-5-methoxypyridin-2-amine
CID 106504454
N-(azetidin-3-yl)-6-tert-butylpyridazin-3-amine
CID 116970920
N-cyclopropyl-5-(2-methoxypropan-2-yl)pyridin-2-amine
CID 59869056
3-[(5-tert-butyl-2-pyridinyl)amino]-1-methylpyrrolidine-2,5-dione
CID 107874760
1-N-(5-tert-butyl-2-pyridinyl)-2,2-dimethylcyclobutane-1,3-diamine
CID 114011750
N-piperidin-4-yl-5-(trifluoromethyl)pyridin-2-amine;trihydrochloride
CID 86276661
5-(5-tert-butyl-2-pyridinyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 107875138
(3aS,6aR)-5-(5-tert-butyl-2-pyridinyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 114042499
5-methyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 68833864

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine?
The IUPAC name of N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine (CID 107875130) is N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine.
What is the SMILES notation for N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine?
The canonical SMILES for N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine is CC(C)(C)c1ccc(NC2CNC2)nc1.
What is the InChIKey of N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine?
The InChIKey is IXYYSWDCSGKFMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-12(2,3)9-4-5-11(14-6-9)15-10-7-13-8-10/h4-6,10,13H,7-8H2,1-3H3,(H,14,15).
What are the key properties of N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine?
N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine has a molecular weight of 205.31 g/mol, XLogP of 1.76, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-5-tert-butylpyridin-2-amine is sourced from PubChem (CID 107875130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).