3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide

C15H25N3O — CID 106278300

IUPAC3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNc1ccc(C(C)(C)C)cn1
InChIInChI=1S/C15H25N3O/c1-14(2,3)11-7-8-12(17-9-11)18-10-15(4,5)13(19)16-6/h7-9H,10H2,1-6H3,(H,16,19)(H,17,18)
InChIKeyYOVKPIKVSCEADO-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.56
Rot. Bonds4

About 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide

3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide (PubChem CID 106278300) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide.

Molecular Properties

Compound Name3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
PubChem CID106278300
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNc1ccc(C(C)(C)C)cn1
InChIInChI=1S/C15H25N3O/c1-14(2,3)11-7-8-12(17-9-11)18-10-15(4,5)13(19)16-6/h7-9H,10H2,1-6H3,(H,16,19)(H,17,18)
InChIKeyYOVKPIKVSCEADO-UHFFFAOYSA-N
XLogP2.56
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide?
The IUPAC name of 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide (CID 106278300) is 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide.
What is the SMILES notation for 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide?
The canonical SMILES for 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide is CNC(=O)C(C)(C)CNc1ccc(C(C)(C)C)cn1.
What is the InChIKey of 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide?
The InChIKey is YOVKPIKVSCEADO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-14(2,3)11-7-8-12(17-9-11)18-10-15(4,5)13(19)16-6/h7-9H,10H2,1-6H3,(H,16,19)(H,17,18).
What are the key properties of 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide?
3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide has a molecular weight of 263.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-tert-butyl-2-pyridinyl)amino]-N,2,2-trimethylpropanamide is sourced from PubChem (CID 106278300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).