2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide

C15H19N5O2 — CID 56814566

IUPAC2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide
SMILESCc1cc(NC(=O)CN(C)CC(N)=O)n(-c2ccccc2)n1
InChIInChI=1S/C15H19N5O2/c1-11-8-14(17-15(22)10-19(2)9-13(16)21)20(18-11)12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3,(H2,16,21)(H,17,22)
InChIKeyIBFVCIYHIMCKHR-UHFFFAOYSA-N
MW301.35 g/mol
LogP0.54
Rot. Bonds6

About 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide

2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide (PubChem CID 56814566) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide.

Molecular Properties

Compound Name2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide
PubChem CID56814566
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Name2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide
SMILESCc1cc(NC(=O)CN(C)CC(N)=O)n(-c2ccccc2)n1
InChIInChI=1S/C15H19N5O2/c1-11-8-14(17-15(22)10-19(2)9-13(16)21)20(18-11)12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3,(H2,16,21)(H,17,22)
InChIKeyIBFVCIYHIMCKHR-UHFFFAOYSA-N
XLogP0.54
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethylphenyl)-2-[methyl-[2-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]amino]acetamide
CID 8789331
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide
CID 9406717
diethyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]azanium
CID 6932117
2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide
CID 7845278
2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylamino]-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide
CID 41236700
ethyl 2-[2-methoxyethyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetate
CID 47082260
1-amino-1-methyl-3-(5-methyl-2-phenylpyrazol-3-yl)thiourea
CID 10635162
2-[[2-[(1,3-diphenylpyrazol-5-yl)amino]-2-oxoethyl]-propan-2-ylamino]acetamide
CID 51243459
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetamide
CID 24664958
2-[methyl-[(2-methylphenyl)methyl]amino]-N-[5-methyl-2-(2-methylphenyl)pyrazol-3-yl]acetamide
CID 17496916
2-[[2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)amino]-2-oxoethyl]-methylamino]-N-methylacetamide
CID 78826187
2-[[2-[[2-(4,6-dimethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]amino]-2-oxoethyl]-methylamino]-N-methylacetamide
CID 78825412

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide?
The IUPAC name of 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide (CID 56814566) is 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide.
What is the SMILES notation for 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide?
The canonical SMILES for 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide is Cc1cc(NC(=O)CN(C)CC(N)=O)n(-c2ccccc2)n1.
What is the InChIKey of 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide?
The InChIKey is IBFVCIYHIMCKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-11-8-14(17-15(22)10-19(2)9-13(16)21)20(18-11)12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3,(H2,16,21)(H,17,22).
What are the key properties of 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide?
2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide has a molecular weight of 301.35 g/mol, XLogP of 0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]amino]acetamide is sourced from PubChem (CID 56814566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).