2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide

C14H22N6O — CID 156585598

IUPAC2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide
SMILESCC(C)c1nccn1C(C)C(=O)Nc1cnn(C(C)C)n1
InChIInChI=1S/C14H22N6O/c1-9(2)13-15-6-7-19(13)11(5)14(21)17-12-8-16-20(18-12)10(3)4/h6-11H,1-5H3,(H,17,18,21)
InChIKeyIJISNRLITXTHER-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.38
Rot. Bonds5

About 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide

2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide (PubChem CID 156585598) has the molecular formula C14H22N6O and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide.

Molecular Properties

Compound Name2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide
PubChem CID156585598
Molecular FormulaC14H22N6O
Molecular Weight290.37 g/mol
Exact Mass290.19
IUPAC Name2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide
SMILESCC(C)c1nccn1C(C)C(=O)Nc1cnn(C(C)C)n1
InChIInChI=1S/C14H22N6O/c1-9(2)13-15-6-7-19(13)11(5)14(21)17-12-8-16-20(18-12)10(3)4/h6-11H,1-5H3,(H,17,18,21)
InChIKeyIJISNRLITXTHER-UHFFFAOYSA-N
XLogP2.38
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-2-(2-propan-2-ylimidazol-1-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide
CID 97190344
(2S)-2-(2-propan-2-ylimidazol-1-yl)-N-[2-(pyridin-3-ylamino)ethyl]propanamide
CID 97279364
(2S)-N-(oxan-4-yl)-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 97191226
2-(2-propan-2-ylimidazol-1-yl)-N-[2-(triazol-1-yl)ethyl]propanamide
CID 122560829
N-[4-[(2-methoxyacetyl)amino]phenyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 131931084
2-(2-propan-2-ylimidazol-1-yl)-N-[2-(2H-triazol-4-ylsulfanyl)ethyl]propanamide
CID 72918314
N-[3-oxo-3-(1,3-thiazol-2-ylamino)propyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 72934835
N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 72890918
N-(5-benzyl-1,3-thiazol-2-yl)-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 46968486
N-[4-(2-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 134703651
(2R)-N-(1-methylsulfonylpiperidin-4-yl)-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 97277858
N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 72935543

Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide?
The IUPAC name of 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide (CID 156585598) is 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide.
What is the SMILES notation for 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide?
The canonical SMILES for 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide is CC(C)c1nccn1C(C)C(=O)Nc1cnn(C(C)C)n1.
What is the InChIKey of 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide?
The InChIKey is IJISNRLITXTHER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O/c1-9(2)13-15-6-7-19(13)11(5)14(21)17-12-8-16-20(18-12)10(3)4/h6-11H,1-5H3,(H,17,18,21).
What are the key properties of 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide?
2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide has a molecular weight of 290.37 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-ylimidazol-1-yl)-N-(2-propan-2-yltriazol-4-yl)propanamide is sourced from PubChem (CID 156585598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).