N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide

C14H20N2O — CID 110856788

IUPACN-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
SMILESCc1ccc(NC(=O)CC2CCCN2C)cc1
InChIInChI=1S/C14H20N2O/c1-11-5-7-12(8-6-11)15-14(17)10-13-4-3-9-16(13)2/h5-8,13H,3-4,9-10H2,1-2H3,(H,15,17)
InChIKeyIMVATYBMXLZZJW-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.42
Rot. Bonds3

About N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide

N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide (PubChem CID 110856788) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
PubChem CID110856788
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
SMILESCc1ccc(NC(=O)CC2CCCN2C)cc1
InChIInChI=1S/C14H20N2O/c1-11-5-7-12(8-6-11)15-14(17)10-13-4-3-9-16(13)2/h5-8,13H,3-4,9-10H2,1-2H3,(H,15,17)
InChIKeyIMVATYBMXLZZJW-UHFFFAOYSA-N
XLogP2.42
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110856796
N-(4-acetylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110861173
N-(4-ethylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110857805
N-(4-tert-butylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110858473
N-(3,4-dimethylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110857374
2-(1-methylpiperidin-2-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 110862093
N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide
CID 110850894
N-(3-chloro-4-methoxyphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110859521
N-[4-[(1-methylpyrrolidin-2-yl)methyl]phenyl]acetamide
CID 23452543
N-(2,6-difluorophenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110865261
N-(2,6-dimethylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110857550
1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide
CID 110856789

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide?
The IUPAC name of N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide (CID 110856788) is N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide.
What is the SMILES notation for N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide?
The canonical SMILES for N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide is Cc1ccc(NC(=O)CC2CCCN2C)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide?
The InChIKey is IMVATYBMXLZZJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-11-5-7-12(8-6-11)15-14(17)10-13-4-3-9-16(13)2/h5-8,13H,3-4,9-10H2,1-2H3,(H,15,17).
What are the key properties of N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide?
N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide has a molecular weight of 232.33 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide is sourced from PubChem (CID 110856788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).