2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide

C16H18N2O — CID 17168099

IUPAC2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide
SMILESCc1ccc(CC(=O)NC(C)c2ccncc2)cc1
InChIInChI=1S/C16H18N2O/c1-12-3-5-14(6-4-12)11-16(19)18-13(2)15-7-9-17-10-8-15/h3-10,13H,11H2,1-2H3,(H,18,19)
InChIKeyMEMNFTNZAARQCB-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.81
Rot. Bonds4

About 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide

2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide (PubChem CID 17168099) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide
PubChem CID17168099
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide
SMILESCc1ccc(CC(=O)NC(C)c2ccncc2)cc1
InChIInChI=1S/C16H18N2O/c1-12-3-5-14(6-4-12)11-16(19)18-13(2)15-7-9-17-10-8-15/h3-10,13H,11H2,1-2H3,(H,18,19)
InChIKeyMEMNFTNZAARQCB-UHFFFAOYSA-N
XLogP2.81
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(aminomethyl)phenyl]-N-(1-pyridin-4-ylethyl)acetamide
CID 63590307
N-(1-pyridin-4-ylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 51272046
2-(3,4-dimethylphenyl)-N-[(1R)-1-pyridin-4-ylethyl]acetamide
CID 51410979
2-(4-acetamidophenyl)-N-[(1R)-1-pyridin-4-ylethyl]acetamide
CID 39964120
2-(4-methylphenyl)-N-(1-pyridin-3-ylethyl)acetamide
CID 18163057
2-(4-carbamothioylphenyl)-N-(1-pyridin-4-ylethyl)acetamide
CID 63590706
2-(4-aminophenyl)-N-[1-(4-methylphenyl)ethyl]acetamide
CID 60927303
2-(4-cyanophenyl)-N-[1-(4-methylphenyl)ethyl]acetamide
CID 62403132
2-(methylamino)-N-[(1S)-1-pyridin-4-ylethyl]acetamide
CID 81409723
1-(4-methylphenyl)-3-(1-pyridin-4-ylethyl)urea
CID 45147289
2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 25337547
2-(4-ethylphenoxy)-N-[(1S)-1-pyridin-4-ylethyl]acetamide
CID 28721742

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide?
The IUPAC name of 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide (CID 17168099) is 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide is Cc1ccc(CC(=O)NC(C)c2ccncc2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide?
The InChIKey is MEMNFTNZAARQCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-12-3-5-14(6-4-12)11-16(19)18-13(2)15-7-9-17-10-8-15/h3-10,13H,11H2,1-2H3,(H,18,19).
What are the key properties of 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide?
2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide has a molecular weight of 254.33 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-(1-pyridin-4-ylethyl)acetamide is sourced from PubChem (CID 17168099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).