N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide

C10H18N4O — CID 155773037

IUPACN-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide
SMILESCC(C)NC(=O)Cc1cn(C(C)C)nn1
InChIInChI=1S/C10H18N4O/c1-7(2)11-10(15)5-9-6-14(8(3)4)13-12-9/h6-8H,5H2,1-4H3,(H,11,15)
InChIKeyCICZZJSCHXHTNJ-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.93
Rot. Bonds4

About N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide

N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide (PubChem CID 155773037) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide
PubChem CID155773037
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide
SMILESCC(C)NC(=O)Cc1cn(C(C)C)nn1
InChIInChI=1S/C10H18N4O/c1-7(2)11-10(15)5-9-6-14(8(3)4)13-12-9/h6-8H,5H2,1-4H3,(H,11,15)
InChIKeyCICZZJSCHXHTNJ-UHFFFAOYSA-N
XLogP0.93
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-2-(1-propan-2-yltriazol-4-yl)acetamide
CID 160790672
3-methyl-1-(1-propan-2-yltriazol-4-yl)butan-2-one
CID 118041108
2-[4-(methylaminomethyl)triazol-1-yl]-N-propan-2-ylpropanamide
CID 66214641
N-propan-2-yl-2-(1-propan-2-ylpyrazol-4-yl)oxyacetamide
CID 116805305
(2S)-2-[4-(phenoxymethyl)triazol-1-yl]-N-propan-2-ylpropanamide
CID 124938453
2-[1-[1-oxo-1-(pentan-3-ylamino)propan-2-yl]triazol-4-yl]acetic acid
CID 107461608
10-(1-propan-2-yltriazol-4-yl)decan-2-one
CID 171604521
9-(1-propan-2-yltriazol-4-yl)nonanoyl iodide
CID 164864596
2-[5-(1-propan-2-yltriazol-4-yl)pentyl]propanedioic acid
CID 172570749
2-(1-methylpyrazol-4-yl)-N-propan-2-ylacetamide
CID 130716283
2-(1-pentan-3-yltriazol-4-yl)acetic acid
CID 107461337
2-(2-methylpropanoyl)-6-[3-(1-propan-2-yltriazol-4-yl)propanoylamino]hexanamide
CID 170201705

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide?
The IUPAC name of N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide (CID 155773037) is N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide.
What is the SMILES notation for N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide?
The canonical SMILES for N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide is CC(C)NC(=O)Cc1cn(C(C)C)nn1.
What is the InChIKey of N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide?
The InChIKey is CICZZJSCHXHTNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-7(2)11-10(15)5-9-6-14(8(3)4)13-12-9/h6-8H,5H2,1-4H3,(H,11,15).
What are the key properties of N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide?
N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide has a molecular weight of 210.28 g/mol, XLogP of 0.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(1-propan-2-yltriazol-4-yl)acetamide is sourced from PubChem (CID 155773037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).