N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide

C16H24N2O — CID 110857208

IUPACN-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide
SMILESCc1ccc(NC(=O)CC2CCCN(C)C2)c(C)c1
InChIInChI=1S/C16H24N2O/c1-12-6-7-15(13(2)9-12)17-16(19)10-14-5-4-8-18(3)11-14/h6-7,9,14H,4-5,8,10-11H2,1-3H3,(H,17,19)
InChIKeyYEUGISKBUDBZEO-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.97
Rot. Bonds3

About N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide

N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide (PubChem CID 110857208) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide
PubChem CID110857208
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide
SMILESCc1ccc(NC(=O)CC2CCCN(C)C2)c(C)c1
InChIInChI=1S/C16H24N2O/c1-12-6-7-15(13(2)9-12)17-16(19)10-14-5-4-8-18(3)11-14/h6-7,9,14H,4-5,8,10-11H2,1-3H3,(H,17,19)
InChIKeyYEUGISKBUDBZEO-UHFFFAOYSA-N
XLogP2.97
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-dimethylphenyl)-2-(1-methylpyrrolidin-3-yl)acetamide
CID 110857203
N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-4-yl)acetamide
CID 95969538
2-(1-methylpiperidin-3-yl)-N-(2,4,6-trimethylphenyl)acetamide
CID 110858213
2-[1-[(2,4-dimethylphenyl)carbamoyl]piperidin-3-yl]acetic acid
CID 62690811
2-(cyclopropylmethylamino)-N-(2,4-dimethylphenyl)acetamide
CID 54924969
N-(2,4-dimethylphenyl)-3-(1-methylpiperidin-4-yl)propanamide
CID 110857210
N-(2-fluorophenyl)-2-(1-methylpiperidin-3-yl)acetamide
CID 110858575
N-(3-bromo-4-methylphenyl)-2-(1-methylpiperidin-3-yl)acetamide
CID 110859779
2-cyclopentylsulfanyl-N-(2,4-dimethylphenyl)acetamide
CID 6456804
N-(4-bromophenyl)-2-(1-methylpiperidin-3-yl)acetamide
CID 110859696
2-(1-methylpiperidin-3-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 110860768
2-[1-(benzenesulfonyl)piperidin-4-yl]-N-(2,4-dimethylphenyl)acetamide
CID 110355965

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide (CID 110857208) is N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide is Cc1ccc(NC(=O)CC2CCCN(C)C2)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide?
The InChIKey is YEUGISKBUDBZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-6-7-15(13(2)9-12)17-16(19)10-14-5-4-8-18(3)11-14/h6-7,9,14H,4-5,8,10-11H2,1-3H3,(H,17,19).
What are the key properties of N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide?
N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-3-yl)acetamide is sourced from PubChem (CID 110857208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).