N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide

C16H24N2O — CID 771509

IUPACN-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide
SMILESCc1cc(C)cc(NC(=O)CCN2CCCCC2)c1
InChIInChI=1S/C16H24N2O/c1-13-10-14(2)12-15(11-13)17-16(19)6-9-18-7-4-3-5-8-18/h10-12H,3-9H2,1-2H3,(H,17,19)
InChIKeyDZAXOXWUFFGOSN-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.12
Rot. Bonds4

About N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide

N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide (PubChem CID 771509) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide
PubChem CID771509
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide
SMILESCc1cc(C)cc(NC(=O)CCN2CCCCC2)c1
InChIInChI=1S/C16H24N2O/c1-13-10-14(2)12-15(11-13)17-16(19)6-9-18-7-4-3-5-8-18/h10-12H,3-9H2,1-2H3,(H,17,19)
InChIKeyDZAXOXWUFFGOSN-UHFFFAOYSA-N
XLogP3.12
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dimethylphenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
CID 2901262
N-(3,5-dimethylphenyl)-3-thiomorpholin-4-ylpropanamide
CID 91837660
ethane;N-(3-methylphenyl)-3-piperidin-1-ylpropanamide
CID 143383579
3-piperidin-1-yl-N-(2,4,6-trimethylphenyl)propanamide
CID 683819
N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide
CID 23906957
N-(3,4-dimethylphenyl)-3-piperidin-1-ylpropanamide
CID 771569
N-(3-bromo-4-methylphenyl)-3-piperidin-1-ylpropanamide
CID 778184
N-(3,5-dimethylphenyl)-3-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide
CID 771548
N-(3,4-dimethylphenyl)-3-piperidin-1-ylpropanamide;oxalic acid
CID 171154670
ethane;N-(3-ethyl-5-hydroxyphenyl)-3-piperidin-1-ylpropanamide
CID 142203256
3-methyl-N-phenyl-5-(4-pyrrolidin-1-ylbutanoylamino)benzamide
CID 71054516
4-(azepan-1-yl)-N-(2,4,6-trimethylphenyl)butanamide
CID 3078502

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide?
The IUPAC name of N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide (CID 771509) is N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide is Cc1cc(C)cc(NC(=O)CCN2CCCCC2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide?
The InChIKey is DZAXOXWUFFGOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13-10-14(2)12-15(11-13)17-16(19)6-9-18-7-4-3-5-8-18/h10-12H,3-9H2,1-2H3,(H,17,19).
What are the key properties of N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide?
N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide is sourced from PubChem (CID 771509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).