N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide

C16H19N3O — CID 43672879

IUPACN-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC(C)c2ccncc2)cc1C
InChIInChI=1S/C16H19N3O/c1-11-10-15(4-5-16(11)19-13(3)20)18-12(2)14-6-8-17-9-7-14/h4-10,12,18H,1-3H3,(H,19,20)
InChIKeyMWCGJDZTSIQDCS-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.52
Rot. Bonds4

About N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide

N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide (PubChem CID 43672879) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide
PubChem CID43672879
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC(C)c2ccncc2)cc1C
InChIInChI=1S/C16H19N3O/c1-11-10-15(4-5-16(11)19-13(3)20)18-12(2)14-6-8-17-9-7-14/h4-10,12,18H,1-3H3,(H,19,20)
InChIKeyMWCGJDZTSIQDCS-UHFFFAOYSA-N
XLogP3.52
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-fluoro-5-(1-pyridin-4-ylethylamino)phenyl]acetamide
CID 60927576
N-[4-[1-(5-fluoro-3-pyridinyl)ethylamino]-2-methylphenyl]acetamide
CID 103935529
N-[2-methyl-4-[[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]acetamide
CID 34284461
N-[2-methyl-4-[[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]acetamide
CID 34284466
N-[2-methyl-4-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]phenyl]acetamide
CID 43672908
N-[4-(butan-2-ylamino)-2-methylphenyl]acetamide
CID 43672867
N-[4-[[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]amino]-2-methylphenyl]acetamide
CID 34284484
N-[4-[[(1R)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]amino]-2-methylphenyl]acetamide
CID 34284478
N-[2-methyl-4-(pentan-3-ylamino)phenyl]acetamide
CID 43672883
N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide
CID 43672852
1-(2,4-dimethylphenyl)-3-[(1R)-1-pyridin-4-ylethyl]urea
CID 40637085
2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline
CID 43189781

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide?
The IUPAC name of N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide (CID 43672879) is N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide.
What is the SMILES notation for N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide?
The canonical SMILES for N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide is CC(=O)Nc1ccc(NC(C)c2ccncc2)cc1C.
What is the InChIKey of N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide?
The InChIKey is MWCGJDZTSIQDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-11-10-15(4-5-16(11)19-13(3)20)18-12(2)14-6-8-17-9-7-14/h4-10,12,18H,1-3H3,(H,19,20).
What are the key properties of N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide?
N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide has a molecular weight of 269.35 g/mol, XLogP of 3.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide is sourced from PubChem (CID 43672879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).