N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide

C16H24N2O — CID 109014553

IUPACN-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide
SMILESCC1CCN(CCC(=O)N(C)c2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-14-8-11-18(12-9-14)13-10-16(19)17(2)15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3
InChIKeyYAXGDGMNYGEOBQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.77
Rot. Bonds4

About N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide

N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide (PubChem CID 109014553) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide.

Molecular Properties

Compound NameN-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide
PubChem CID109014553
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide
SMILESCC1CCN(CCC(=O)N(C)c2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-14-8-11-18(12-9-14)13-10-16(19)17(2)15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3
InChIKeyYAXGDGMNYGEOBQ-UHFFFAOYSA-N
XLogP2.77
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-phenyl-3-piperidin-1-ylpropanamide
CID 110688340
N-methyl-3-(4-methylpiperazin-1-yl)-N-phenylpropanamide
CID 110856844
N-benzyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide
CID 109014601
3-[4-[2-(N-methylanilino)-2-oxoethyl]piperazin-1-yl]propanoic acid
CID 134069440
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-methyl-N-phenylpropanamide
CID 109029653
3-(4-methylazepan-1-yl)-1-phenylpropan-1-one
CID 55249403
2-(4-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide
CID 62656804
N-(4-aminophenyl)-N-methyl-3-(4-methylpiperazin-1-yl)propanamide
CID 69059607
3-hydroxy-N-methyl-N-phenylpropanamide
CID 82111467
4-(3-methoxypiperidin-1-yl)-N-methyl-N-phenylbutanamide
CID 86744370
CID 173431785
CID 173431785
2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-methyl-N-phenylacetamide;hydrochloride
CID 119927602

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide?
The IUPAC name of N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide (CID 109014553) is N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide.
What is the SMILES notation for N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide?
The canonical SMILES for N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide is CC1CCN(CCC(=O)N(C)c2ccccc2)CC1.
What is the InChIKey of N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide?
The InChIKey is YAXGDGMNYGEOBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-14-8-11-18(12-9-14)13-10-16(19)17(2)15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3.
What are the key properties of N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide?
N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 2.77, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide is sourced from PubChem (CID 109014553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).