2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide

C13H16N4O — CID 54896815

IUPAC2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide
SMILESCc1[nH]ncc1CNC(=O)C(N)c1ccccc1
InChIInChI=1S/C13H16N4O/c1-9-11(8-16-17-9)7-15-13(18)12(14)10-5-3-2-4-6-10/h2-6,8,12H,7,14H2,1H3,(H,15,18)(H,16,17)
InChIKeyNRUJMLUDOSACOJ-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.03
Rot. Bonds4

About 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide

2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide (PubChem CID 54896815) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide
PubChem CID54896815
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide
SMILESCc1[nH]ncc1CNC(=O)C(N)c1ccccc1
InChIInChI=1S/C13H16N4O/c1-9-11(8-16-17-9)7-15-13(18)12(14)10-5-3-2-4-6-10/h2-6,8,12H,7,14H2,1H3,(H,15,18)(H,16,17)
InChIKeyNRUJMLUDOSACOJ-UHFFFAOYSA-N
XLogP1.03
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-2-(1-methylpyrazol-4-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide
CID 113279847
(2R)-2-amino-3-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]butanamide
CID 79013070
(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide
CID 104941421
(2S)-2-amino-N-[(4-methylthiophen-3-yl)methyl]-2-phenylacetamide
CID 104898150
2-amino-N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-phenylacetamide
CID 112669565
2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylpropanamide
CID 62487194
3,3,3-trifluoro-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(trifluoromethyl)propanamide
CID 103310272
2-amino-N-[[2-(methoxymethyl)phenyl]methyl]-2-phenylacetamide
CID 60924991
3-amino-2-methoxy-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide
CID 106112236
(2R)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-thiophen-2-ylpropanamide
CID 99809710
2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide
CID 60767988
(2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide
CID 64529573

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide?
The IUPAC name of 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide (CID 54896815) is 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide is Cc1[nH]ncc1CNC(=O)C(N)c1ccccc1.
What is the InChIKey of 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide?
The InChIKey is NRUJMLUDOSACOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-9-11(8-16-17-9)7-15-13(18)12(14)10-5-3-2-4-6-10/h2-6,8,12H,7,14H2,1H3,(H,15,18)(H,16,17).
What are the key properties of 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide?
2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide has a molecular weight of 244.30 g/mol, XLogP of 1.03, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide is sourced from PubChem (CID 54896815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).