N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide

C10H17N3O2 — CID 112687011

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide
SMILESCc1n[nH]c(C)c1NC(=O)COC(C)C
InChIInChI=1S/C10H17N3O2/c1-6(2)15-5-9(14)11-10-7(3)12-13-8(10)4/h6H,5H2,1-4H3,(H,11,14)(H,12,13)
InChIKeyQYYDHXMPLDNIDL-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.39
Rot. Bonds4

About N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide (PubChem CID 112687011) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide
PubChem CID112687011
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide
SMILESCc1n[nH]c(C)c1NC(=O)COC(C)C
InChIInChI=1S/C10H17N3O2/c1-6(2)15-5-9(14)11-10-7(3)12-13-8(10)4/h6H,5H2,1-4H3,(H,11,14)(H,12,13)
InChIKeyQYYDHXMPLDNIDL-UHFFFAOYSA-N
XLogP1.39
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(4-propan-2-ylphenoxy)acetamide
CID 43397481
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylbutanamide
CID 43546964
4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobutanoic acid
CID 16645428
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide
CID 126991153
methyl 3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]-2-oxoethyl]sulfanyl-2-methylpropanoate
CID 66113995
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
CID 43547720
5-bromo-N-(3,5-dimethyl-1H-pyrazol-4-yl)pentanamide
CID 107908306
2-[1-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]-2-oxoethyl]azetidin-3-yl]propanoic acid
CID 116683852
(2R,3R)-2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-methylpentanamide
CID 93240679
2-(4-aminophenoxy)-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 55124971
2-(4-chlorophenoxy)-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 5305539
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(2-hydroxyphenoxy)acetamide
CID 43546519

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide (CID 112687011) is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide is Cc1n[nH]c(C)c1NC(=O)COC(C)C.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide?
The InChIKey is QYYDHXMPLDNIDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-6(2)15-5-9(14)11-10-7(3)12-13-8(10)4/h6H,5H2,1-4H3,(H,11,14)(H,12,13).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide has a molecular weight of 211.26 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide is sourced from PubChem (CID 112687011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).