2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide

C15H20N4O2 — CID 62111534

IUPAC2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide
SMILESCCOCc1ccccc1CNC(=O)Cn1ccc(N)n1
InChIInChI=1S/C15H20N4O2/c1-2-21-11-13-6-4-3-5-12(13)9-17-15(20)10-19-8-7-14(16)18-19/h3-8H,2,9-11H2,1H3,(H2,16,18)(H,17,20)
InChIKeyYNMMMTMJCHCEJF-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.32
Rot. Bonds7

About 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide

2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide (PubChem CID 62111534) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide
PubChem CID62111534
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide
SMILESCCOCc1ccccc1CNC(=O)Cn1ccc(N)n1
InChIInChI=1S/C15H20N4O2/c1-2-21-11-13-6-4-3-5-12(13)9-17-15(20)10-19-8-7-14(16)18-19/h3-8H,2,9-11H2,1H3,(H2,16,18)(H,17,20)
InChIKeyYNMMMTMJCHCEJF-UHFFFAOYSA-N
XLogP1.32
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-aminopyrazol-1-yl)-N-[(2-fluorophenyl)methyl]acetamide
CID 55035632
2-(3-aminopyrazol-1-yl)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]acetamide
CID 62113226
3-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide
CID 119949733
3-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide;hydrochloride
CID 119949732
2-(3-aminopyrazol-1-yl)-N-methylacetamide
CID 60783095
N-[[2-(ethoxymethyl)phenyl]methyl]-2-(1-methyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)acetamide
CID 37397903
N-[[2-(ethoxymethyl)phenyl]methyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 37397619
(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]pentanamide
CID 93359004
4-chloro-N-[[2-(ethoxymethyl)phenyl]methyl]butanamide
CID 63308069
methyl 2-[[2-(3-aminopyrazol-1-yl)acetyl]amino]benzoate
CID 62100724
(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]propanamide;hydrochloride
CID 119286563
2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-2-methylpropanamide
CID 61266399

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide (CID 62111534) is 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide is CCOCc1ccccc1CNC(=O)Cn1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide?
The InChIKey is YNMMMTMJCHCEJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-2-21-11-13-6-4-3-5-12(13)9-17-15(20)10-19-8-7-14(16)18-19/h3-8H,2,9-11H2,1H3,(H2,16,18)(H,17,20).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide?
2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide has a molecular weight of 288.35 g/mol, XLogP of 1.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 62111534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).