2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide

C15H20N4O — CID 61105405

IUPAC2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide
SMILESCCN(Cc1cccc(C)c1)C(=O)Cn1cc(N)cn1
InChIInChI=1S/C15H20N4O/c1-3-18(9-13-6-4-5-12(2)7-13)15(20)11-19-10-14(16)8-17-19/h4-8,10H,3,9,11,16H2,1-2H3
InChIKeyZIQOZXKMTGZTLT-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.82
Rot. Bonds5

About 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide

2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide (PubChem CID 61105405) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide
PubChem CID61105405
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide
SMILESCCN(Cc1cccc(C)c1)C(=O)Cn1cc(N)cn1
InChIInChI=1S/C15H20N4O/c1-3-18(9-13-6-4-5-12(2)7-13)15(20)11-19-10-14(16)8-17-19/h4-8,10H,3,9,11,16H2,1-2H3
InChIKeyZIQOZXKMTGZTLT-UHFFFAOYSA-N
XLogP1.82
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N-[(3-methylphenyl)methyl]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide
CID 47058565
1-[(3-methylphenyl)methyl]pyrazol-4-amine
CID 7017120
2-(4-aminopyrazol-1-yl)-N,N-dipropylacetamide
CID 43445164
3-amino-N-ethyl-N-[(3-methylphenyl)methyl]benzamide
CID 60939211
2-(4-aminopyrazol-1-yl)-N-[(3-chlorophenyl)methyl]-N-propan-2-ylacetamide
CID 61106727
4-amino-N-ethyl-5-methyl-N-[(3-methylphenyl)methyl]thiophene-2-carboxamide
CID 61105975
2-(2-aminoethoxy)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide
CID 79472813
N-[(3-aminophenyl)methyl]-N-ethyl-2,5-dimethylbenzamide
CID 43458950
N-[2-[benzyl(ethyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
CID 112992909
2-(4-aminopyrazol-1-yl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide
CID 43574113
2-amino-6-chloro-N-ethyl-N-[(3-methylphenyl)methyl]benzamide
CID 63658797
2-(4-aminopyrazol-1-yl)-N-cyclopropyl-N-ethylacetamide
CID 43445485

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide (CID 61105405) is 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide is CCN(Cc1cccc(C)c1)C(=O)Cn1cc(N)cn1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide?
The InChIKey is ZIQOZXKMTGZTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-3-18(9-13-6-4-5-12(2)7-13)15(20)11-19-10-14(16)8-17-19/h4-8,10H,3,9,11,16H2,1-2H3.
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide?
2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide has a molecular weight of 272.35 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-ethyl-N-[(3-methylphenyl)methyl]acetamide is sourced from PubChem (CID 61105405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).