2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide

C16H18N2O — CID 25337547

IUPAC2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
SMILESCc1ccc(CC(=O)N[C@H](C)c2ccccn2)cc1
InChIInChI=1S/C16H18N2O/c1-12-6-8-14(9-7-12)11-16(19)18-13(2)15-5-3-4-10-17-15/h3-10,13H,11H2,1-2H3,(H,18,19)/t13-/m1/s1
InChIKeyKIOAQBIEKPZYHZ-CYBMUJFWSA-N
MW254.33 g/mol
LogP2.81
Rot. Bonds4

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

2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide (PubChem CID 25337547) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
PubChem CID25337547
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
SMILESCc1ccc(CC(=O)N[C@H](C)c2ccccn2)cc1
InChIInChI=1S/C16H18N2O/c1-12-6-8-14(9-7-12)11-16(19)18-13(2)15-5-3-4-10-17-15/h3-10,13H,11H2,1-2H3,(H,18,19)/t13-/m1/s1
InChIKeyKIOAQBIEKPZYHZ-CYBMUJFWSA-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-(3,4-dichlorophenyl)-N-(1-pyridin-2-ylethyl)acetamide
CID 47097455
N-[(1R)-1-pyridin-2-ylethyl]propanamide
CID 59509331
2-(2-hydroxyphenyl)-N-(1-pyridin-2-ylethyl)acetamide
CID 78990806
2-bromo-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 81401514
2-(2-chlorophenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 25337037
3-(2,4-dimethylphenyl)-N-(1-pyridin-2-ylethyl)propanamide
CID 24645511
2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 41194976
2-(propan-2-ylamino)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81407440
2-methoxy-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81407538
4-oxo-4-(1-pyridin-2-ylethylamino)butanoic acid
CID 43529024
3-amino-N-(1-pyridin-2-ylethyl)butanamide;dihydrochloride
CID 119830348
2-(tert-butylamino)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81406863

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The IUPAC name of 2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide (CID 25337547) is 2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide is Cc1ccc(CC(=O)N[C@H](C)c2ccccn2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The InChIKey is KIOAQBIEKPZYHZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H18N2O/c1-12-6-8-14(9-7-12)11-16(19)18-13(2)15-5-3-4-10-17-15/h3-10,13H,11H2,1-2H3,(H,18,19)/t13-/m1/s1.
What are the key properties of 2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-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-[(1R)-1-pyridin-2-ylethyl]acetamide is sourced from PubChem (CID 25337547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).