2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide

C18H22N4O2 — CID 75377260

IUPAC2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide
SMILESCc1cc(C)c(NC(=O)CN(C)c2cc(C(N)=O)ccn2)c(C)c1
InChIInChI=1S/C18H22N4O2/c1-11-7-12(2)17(13(3)8-11)21-16(23)10-22(4)15-9-14(18(19)24)5-6-20-15/h5-9H,10H2,1-4H3,(H2,19,24)(H,21,23)
InChIKeyAEAYFXKVBPMKIR-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.18
Rot. Bonds5

About 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide

2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide (PubChem CID 75377260) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide
PubChem CID75377260
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide
SMILESCc1cc(C)c(NC(=O)CN(C)c2cc(C(N)=O)ccn2)c(C)c1
InChIInChI=1S/C18H22N4O2/c1-11-7-12(2)17(13(3)8-11)21-16(23)10-22(4)15-9-14(18(19)24)5-6-20-15/h5-9H,10H2,1-4H3,(H2,19,24)(H,21,23)
InChIKeyAEAYFXKVBPMKIR-UHFFFAOYSA-N
XLogP2.18
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[methyl-(5-nitro-2-pyridinyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 30640551
6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide
CID 133359145
2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetamide
CID 9338949
2-[methyl-(3-nitro-2-pyridinyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 9196076
2-(dimethylamino)-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
CID 138400573
4-[4-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]carbamoyl]phenoxy]benzamide
CID 56546028
2-[(6-chloroquinolin-4-yl)-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 133339048
2-[methyl(pyridin-4-ylmethyl)amino]pyridine-4-carboxamide
CID 75374046
2-[methyl-(4-methyl-2-pyridinyl)amino]acetamide
CID 130650937
4-[2-oxo-2-(2,4,6-trimethylanilino)ethoxy]benzamide
CID 7931575
2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-phenylacetamide
CID 9339160
2-[(5-bromothiophen-2-yl)methyl-methylamino]pyridine-4-carboxamide
CID 56822846

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide?
The IUPAC name of 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide (CID 75377260) is 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide.
What is the SMILES notation for 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide?
The canonical SMILES for 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide is Cc1cc(C)c(NC(=O)CN(C)c2cc(C(N)=O)ccn2)c(C)c1.
What is the InChIKey of 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide?
The InChIKey is AEAYFXKVBPMKIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-11-7-12(2)17(13(3)8-11)21-16(23)10-22(4)15-9-14(18(19)24)5-6-20-15/h5-9H,10H2,1-4H3,(H2,19,24)(H,21,23).
What are the key properties of 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide?
2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide is sourced from PubChem (CID 75377260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).