6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine

C14H25N3 — CID 113381451

IUPAC6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCC(C)CNCc1cc(N)nc(C(C)(C)C)c1
InChIInChI=1S/C14H25N3/c1-10(2)8-16-9-11-6-12(14(3,4)5)17-13(15)7-11/h6-7,10,16H,8-9H2,1-5H3,(H2,15,17)
InChIKeyORHKRHOUHBKQNF-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.71
Rot. Bonds4

About 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine

6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine (PubChem CID 113381451) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
PubChem CID113381451
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCC(C)CNCc1cc(N)nc(C(C)(C)C)c1
InChIInChI=1S/C14H25N3/c1-10(2)8-16-9-11-6-12(14(3,4)5)17-13(15)7-11/h6-7,10,16H,8-9H2,1-5H3,(H2,15,17)
InChIKeyORHKRHOUHBKQNF-UHFFFAOYSA-N
XLogP2.71
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-tert-butyl-6-methoxy-4-pyridinyl)methyl]-2-methylpropan-1-amine
CID 113381553
2-amino-6-tert-butyl-N-(2-methylpropyl)pyridine-4-carboxamide
CID 113380941
N-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]-2-methylpropan-1-amine
CID 62922160
N-[(2-tert-butyl-7,8-dimethylquinolin-4-yl)methyl]-2-methylpropan-1-amine
CID 82448482
N-[(2-tert-butyl-6-pentan-2-yloxy-4-pyridinyl)methyl]ethanamine
CID 102985986
4-N-(2-methylpropyl)pyrimidine-2,4,6-triamine
CID 80770441
N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 102700801
6-tert-butyl-2-ethyl-4-[(2-methylpropylamino)methyl]pyridazin-3-one
CID 82443565
N-[(2-tert-butyl-4,6-dimethylpyrimidin-5-yl)methyl]-2-methylpropan-1-amine
CID 62746709
N-benzyl-2-methylpropan-1-amine;ethane
CID 142079167
6-tert-butyl-2-chloropyrimidin-4-amine
CID 58008872
2-methyl-N-[(4-trimethylsilylphenyl)methyl]propan-1-amine
CID 103437435

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine?
The IUPAC name of 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine (CID 113381451) is 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine.
What is the SMILES notation for 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine?
The canonical SMILES for 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine is CC(C)CNCc1cc(N)nc(C(C)(C)C)c1.
What is the InChIKey of 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine?
The InChIKey is ORHKRHOUHBKQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-10(2)8-16-9-11-6-12(14(3,4)5)17-13(15)7-11/h6-7,10,16H,8-9H2,1-5H3,(H2,15,17).
What are the key properties of 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine?
6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine has a molecular weight of 235.37 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 113381451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).