2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide

C18H17N3O2 — CID 75435377

IUPAC2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide
SMILESCc1cc(CC(=O)NCC(=O)c2cccc3ccccc23)n[nH]1
InChIInChI=1S/C18H17N3O2/c1-12-9-14(21-20-12)10-18(23)19-11-17(22)16-8-4-6-13-5-2-3-7-15(13)16/h2-9H,10-11H2,1H3,(H,19,23)(H,20,21)
InChIKeyYCZYCYFFMMNHGN-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.41
Rot. Bonds5

About 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide

2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide (PubChem CID 75435377) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide.

Molecular Properties

Compound Name2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide
PubChem CID75435377
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide
SMILESCc1cc(CC(=O)NCC(=O)c2cccc3ccccc23)n[nH]1
InChIInChI=1S/C18H17N3O2/c1-12-9-14(21-20-12)10-18(23)19-11-17(22)16-8-4-6-13-5-2-3-7-15(13)16/h2-9H,10-11H2,1H3,(H,19,23)(H,20,21)
InChIKeyYCZYCYFFMMNHGN-UHFFFAOYSA-N
XLogP2.41
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-2-[[2-(5-methyl-1H-pyrazol-3-yl)acetyl]amino]benzamide;hydrochloride
CID 120604073
N-[(2S)-2-(2,6-dichlorophenyl)-2-hydroxyethyl]-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 97222976
3,3,3-trifluoro-N-(2-naphthalen-1-yl-2-oxoethyl)propanamide
CID 75435338
2-(2,5-dimethylphenyl)-N-[(5-methyl-1H-pyrazol-3-yl)methyl]acetamide
CID 166204960
N-[2-(methylamino)propyl]-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 120827526
2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-naphthalen-1-ylethanone
CID 735666
N-[(2S,4R)-4-hydroxy-4-phenylbutan-2-yl]-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 97228090
N-[(2R)-2-(ethylamino)propyl]-2-(5-methyl-1H-pyrazol-3-yl)acetamide;hydrochloride
CID 120652004
N-[(5-methyl-1H-pyrazol-3-yl)methyl]-3-phenylbenzamide
CID 91773131
3-naphthalen-1-yl-3-oxopropanoate
CID 22261669
N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 71918400
N-(2,4-dimethylphenyl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 110857186

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide?
The IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide (CID 75435377) is 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide.
What is the SMILES notation for 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide?
The canonical SMILES for 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide is Cc1cc(CC(=O)NCC(=O)c2cccc3ccccc23)n[nH]1.
What is the InChIKey of 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide?
The InChIKey is YCZYCYFFMMNHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-12-9-14(21-20-12)10-18(23)19-11-17(22)16-8-4-6-13-5-2-3-7-15(13)16/h2-9H,10-11H2,1H3,(H,19,23)(H,20,21).
What are the key properties of 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide?
2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide has a molecular weight of 307.35 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-pyrazol-3-yl)-N-(2-naphthalen-1-yl-2-oxoethyl)acetamide is sourced from PubChem (CID 75435377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).