4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide

C19H23N3O3 — CID 167982720

IUPAC4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide
SMILESCc1cc(NC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)[nH]c(=O)c1
InChIInChI=1S/C19H23N3O3/c1-12-9-15(21-16(23)10-12)22-17(24)11-20-18(25)13-5-7-14(8-6-13)19(2,3)4/h5-10H,11H2,1-4H3,(H,20,25)(H2,21,22,23,24)
InChIKeyADKRURATQBKWFO-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.35
Rot. Bonds4

About 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide

4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide (PubChem CID 167982720) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide
PubChem CID167982720
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide
SMILESCc1cc(NC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)[nH]c(=O)c1
InChIInChI=1S/C19H23N3O3/c1-12-9-15(21-16(23)10-12)22-17(24)11-20-18(25)13-5-7-14(8-6-13)19(2,3)4/h5-10H,11H2,1-4H3,(H,20,25)(H2,21,22,23,24)
InChIKeyADKRURATQBKWFO-UHFFFAOYSA-N
XLogP2.35
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-tert-butyl-N-[2-(2,6-dichloroanilino)-2-oxoethyl]benzamide
CID 113001418
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CID 38467290
4-tert-butyl-N-[2-(3-methylsulfanylanilino)-2-oxoethyl]benzamide
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4-tert-butyl-N-[2-oxo-2-[(4-oxo-1H-pyridin-2-yl)methylamino]ethyl]benzamide
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4-tert-butyl-N-[2-(3-fluoroanilino)-2-oxoethyl]benzamide
CID 772126
N-[2-(3,5-dichloroanilino)-2-oxoethyl]-4-methylbenzamide
CID 46756068
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CID 26696338
N-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]-4-tert-butylbenzamide
CID 9111149
4-tert-butyl-N-[2-oxo-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]ethyl]benzamide
CID 27743223
N-[2-(4-tert-butylanilino)-2-oxoethyl]-3-methyl-4-nitrobenzamide
CID 112768467
N-[2-(2-tert-butylanilino)-2-oxoethyl]-4-chlorobenzamide
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N-[2-[2-(4-fluorobenzoyl)hydrazinyl]-2-oxoethyl]-3,5-dimethylbenzamide
CID 86976055

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide (CID 167982720) is 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide is Cc1cc(NC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)[nH]c(=O)c1.
What is the InChIKey of 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide?
The InChIKey is ADKRURATQBKWFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-12-9-15(21-16(23)10-12)22-17(24)11-20-18(25)13-5-7-14(8-6-13)19(2,3)4/h5-10H,11H2,1-4H3,(H,20,25)(H2,21,22,23,24).
What are the key properties of 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide?
4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide has a molecular weight of 341.41 g/mol, XLogP of 2.35, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[2-[(4-methyl-6-oxo-1H-pyridin-2-yl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 167982720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).