N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide

C11H19N3O — CID 60705335

IUPACN-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
SMILESCCCNC(=O)Cc1c(C)nn(C)c1C
InChIInChI=1S/C11H19N3O/c1-5-6-12-11(15)7-10-8(2)13-14(4)9(10)3/h5-7H2,1-4H3,(H,12,15)
InChIKeyRNWOGSAAKUMYSV-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.11
Rot. Bonds4

About N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide

N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide (PubChem CID 60705335) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
PubChem CID60705335
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
SMILESCCCNC(=O)Cc1c(C)nn(C)c1C
InChIInChI=1S/C11H19N3O/c1-5-6-12-11(15)7-10-8(2)13-14(4)9(10)3/h5-7H2,1-4H3,(H,12,15)
InChIKeyRNWOGSAAKUMYSV-UHFFFAOYSA-N
XLogP1.11
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylbutyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 110695387
N-(3,3-diphenylpropyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 24663985
N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]pentanamide
CID 86930102
N-[2-(methylamino)propyl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide;dihydrochloride
CID 120828294
ethyl 2-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]propanoate
CID 61342578
N-(3-phenylbutyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 51103832
N-[2-(3,6-dihydro-2H-pyridin-1-yl)ethyl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 132970684
N-[2-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]ethyl]furan-2-carboxamide
CID 38231081
N-[2-(4-chlorophenyl)sulfanylethyl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 41444293
N-(4-hydroxy-2-methylbutyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 66106247
N-(2-hydroxy-2,3-dimethylpentyl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 111446406
2-methyl-2-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]propanoic acid
CID 61261702

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The IUPAC name of N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide (CID 60705335) is N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide.
What is the SMILES notation for N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The canonical SMILES for N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide is CCCNC(=O)Cc1c(C)nn(C)c1C.
What is the InChIKey of N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The InChIKey is RNWOGSAAKUMYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-5-6-12-11(15)7-10-8(2)13-14(4)9(10)3/h5-7H2,1-4H3,(H,12,15).
What are the key properties of N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide?
N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide has a molecular weight of 209.29 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide is sourced from PubChem (CID 60705335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).