2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide

C23H26N4O — CID 142792500

IUPAC2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide
SMILESCc1cccc(C(NCCc2ccncc2CCc2cccnc2)C(N)=O)c1
InChIInChI=1S/C23H26N4O/c1-17-4-2-6-20(14-17)22(23(24)28)27-13-10-19-9-12-26-16-21(19)8-7-18-5-3-11-25-15-18/h2-6,9,11-12,14-16,22,27H,7-8,10,13H2,1H3,(H2,24,28)
InChIKeyXHSYKDSJYSZYSQ-UHFFFAOYSA-N
MW374.49 g/mol
LogP2.93
Rot. Bonds9

About 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide

2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide (PubChem CID 142792500) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide.

Molecular Properties

Compound Name2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide
PubChem CID142792500
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide
SMILESCc1cccc(C(NCCc2ccncc2CCc2cccnc2)C(N)=O)c1
InChIInChI=1S/C23H26N4O/c1-17-4-2-6-20(14-17)22(23(24)28)27-13-10-19-9-12-26-16-21(19)8-7-18-5-3-11-25-15-18/h2-6,9,11-12,14-16,22,27H,7-8,10,13H2,1H3,(H2,24,28)
InChIKeyXHSYKDSJYSZYSQ-UHFFFAOYSA-N
XLogP2.93
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methoxyphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide
CID 142792584
2-(2,5-dimethylphenyl)-2-[[3-(pyridin-3-ylmethyl)-4-pyridinyl]methylamino]acetamide
CID 142792332
N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 105090642
2-(3-bromophenyl)-2-(2-pyridin-3-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide
CID 56932438
(2S)-2-(3-bromophenyl)-2-[methyl(pyridin-3-ylmethyl)amino]acetamide
CID 97331831
N-carbamoyl-2-(2-pyridin-3-ylethylamino)propanamide
CID 60914787
2-(3-bromophenyl)-2-[2-pyridin-3-ylethyl(2-pyridin-4-ylethyl)amino]acetamide
CID 142792081
2-(3-methylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 21366996
2-(3-chlorophenyl)-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide
CID 142791990
(2R)-2-(3-methylphenyl)-2-[[4-(pyridin-3-ylmethyl)piperazine-1-carbonyl]amino]acetic acid
CID 126438621
2-(4-bromophenyl)-N-(2-pyridin-3-ylethyl)-2-(2-pyridin-4-ylethylamino)acetamide
CID 56932484
N'-[(3-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)oxamide
CID 108984681

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide?
The IUPAC name of 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide (CID 142792500) is 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide.
What is the SMILES notation for 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide?
The canonical SMILES for 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide is Cc1cccc(C(NCCc2ccncc2CCc2cccnc2)C(N)=O)c1.
What is the InChIKey of 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide?
The InChIKey is XHSYKDSJYSZYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c1-17-4-2-6-20(14-17)22(23(24)28)27-13-10-19-9-12-26-16-21(19)8-7-18-5-3-11-25-15-18/h2-6,9,11-12,14-16,22,27H,7-8,10,13H2,1H3,(H2,24,28).
What are the key properties of 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide?
2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide has a molecular weight of 374.49 g/mol, XLogP of 2.93, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-2-[2-[3-(2-pyridin-3-ylethyl)-4-pyridinyl]ethylamino]acetamide is sourced from PubChem (CID 142792500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).