4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine

C14H25N3 — CID 113381296

IUPAC4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine
SMILESCC(C)N(C)c1cc(CN)cc(C(C)(C)C)n1
InChIInChI=1S/C14H25N3/c1-10(2)17(6)13-8-11(9-15)7-12(16-13)14(3,4)5/h7-8,10H,9,15H2,1-6H3
InChIKeyQTYGQXXXAKWZHD-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.68
Rot. Bonds3

About 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine

4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine (PubChem CID 113381296) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine
PubChem CID113381296
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine
SMILESCC(C)N(C)c1cc(CN)cc(C(C)(C)C)n1
InChIInChI=1S/C14H25N3/c1-10(2)17(6)13-8-11(9-15)7-12(16-13)14(3,4)5/h7-8,10H,9,15H2,1-6H3
InChIKeyQTYGQXXXAKWZHD-UHFFFAOYSA-N
XLogP2.68
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine?
The IUPAC name of 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine (CID 113381296) is 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine is CC(C)N(C)c1cc(CN)cc(C(C)(C)C)n1.
What is the InChIKey of 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine?
The InChIKey is QTYGQXXXAKWZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-10(2)17(6)13-8-11(9-15)7-12(16-13)14(3,4)5/h7-8,10H,9,15H2,1-6H3.
What are the key properties of 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine?
4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine has a molecular weight of 235.37 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-6-tert-butyl-N-methyl-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 113381296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).