N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide

C19H21N3O2 — CID 19290341

IUPACN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide
SMILESCCn1ncc(CNC(=O)COc2ccc3ccccc3c2)c1C
InChIInChI=1S/C19H21N3O2/c1-3-22-14(2)17(12-21-22)11-20-19(23)13-24-18-9-8-15-6-4-5-7-16(15)10-18/h4-10,12H,3,11,13H2,1-2H3,(H,20,23)
InChIKeyOCQBNJFEHMVSMS-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.06
Rot. Bonds6

About N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide

N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide (PubChem CID 19290341) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide
PubChem CID19290341
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide
SMILESCCn1ncc(CNC(=O)COc2ccc3ccccc3c2)c1C
InChIInChI=1S/C19H21N3O2/c1-3-22-14(2)17(12-21-22)11-20-19(23)13-24-18-9-8-15-6-4-5-7-16(15)10-18/h4-10,12H,3,11,13H2,1-2H3,(H,20,23)
InChIKeyOCQBNJFEHMVSMS-UHFFFAOYSA-N
XLogP3.06
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-naphthalen-2-yloxy-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide
CID 7583241
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide
CID 19290408
N-[(3,5-dimethoxyphenyl)methyl]-2-naphthalen-2-yloxyacetamide
CID 55577770
2-(7-methoxynaphthalen-2-yl)oxy-N-[(2-methoxyphenyl)methyl]acetamide
CID 7652672
N-(3-ethoxypropyl)-2-naphthalen-2-yloxyacetamide
CID 35292228
N-(cyanomethyl)-2-naphthalen-2-yloxyacetamide
CID 51103110
N-(2-acetamidoethyl)-2-naphthalen-2-yloxyacetamide
CID 7942082
N-[(3-methyl-4-oxophthalazin-1-yl)methyl]-2-naphthalen-2-yloxyacetamide
CID 90489974
3-ethyl-N'-(2-naphthalen-2-yloxyacetyl)-4-oxophthalazine-1-carbohydrazide
CID 7979968
N-(2-amino-2-ethylbutyl)-2-naphthalen-2-yloxyacetamide
CID 119639639
N-[2-(ethylamino)ethyl]-2-naphthalen-2-yloxyacetamide;hydrochloride
CID 119504571
N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-yloxyacetamide
CID 18167335

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide (CID 19290341) is N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide is CCn1ncc(CNC(=O)COc2ccc3ccccc3c2)c1C.
What is the InChIKey of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is OCQBNJFEHMVSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-3-22-14(2)17(12-21-22)11-20-19(23)13-24-18-9-8-15-6-4-5-7-16(15)10-18/h4-10,12H,3,11,13H2,1-2H3,(H,20,23).
What are the key properties of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide?
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 323.40 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 19290341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).