N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide

C17H26N2O — CID 62212541

IUPACN-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide
SMILESCCN(C(=O)CCC1CCCCN1)c1cccc(C)c1
InChIInChI=1S/C17H26N2O/c1-3-19(16-9-6-7-14(2)13-16)17(20)11-10-15-8-4-5-12-18-15/h6-7,9,13,15,18H,3-5,8,10-12H2,1-2H3
InChIKeyLXDHWFIMMNBSKM-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.27
Rot. Bonds5

About N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide

N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide (PubChem CID 62212541) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide
PubChem CID62212541
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide
SMILESCCN(C(=O)CCC1CCCCN1)c1cccc(C)c1
InChIInChI=1S/C17H26N2O/c1-3-19(16-9-6-7-14(2)13-16)17(20)11-10-15-8-4-5-12-18-15/h6-7,9,13,15,18H,3-5,8,10-12H2,1-2H3
InChIKeyLXDHWFIMMNBSKM-UHFFFAOYSA-N
XLogP3.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(3-methylphenyl)-3-piperidin-4-ylpropanamide
CID 62212377
N-ethyl-N-(2-methylphenyl)-3-piperidin-2-ylpropanamide
CID 62210137
N-methyl-N-phenyl-3-piperidin-2-ylpropanamide
CID 62211013
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
3-[cyclopentyl(methylsulfonyl)amino]-N-ethyl-N-(3-methylphenyl)propanamide
CID 113137357
N-(3-aminophenyl)-3-cyclopentyl-N-ethylpropanamide
CID 63229916
N-(3-methoxyphenyl)-N-methyl-3-piperidin-2-ylpropanamide
CID 62211493
N-cyclopentyl-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108942305
2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide
CID 113159596
N-ethyl-3-methyl-N-(3-pyrrolidin-2-ylpropyl)aniline
CID 55076467
N-ethyl-N-(3-methylphenyl)cyclohexanecarboxamide
CID 533210
N-[2-(3-methylphenyl)ethyl]-3-piperidin-2-ylpropanamide
CID 62315398

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide?
The IUPAC name of N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide (CID 62212541) is N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide.
What is the SMILES notation for N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide?
The canonical SMILES for N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide is CCN(C(=O)CCC1CCCCN1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide?
The InChIKey is LXDHWFIMMNBSKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-19(16-9-6-7-14(2)13-16)17(20)11-10-15-8-4-5-12-18-15/h6-7,9,13,15,18H,3-5,8,10-12H2,1-2H3.
What are the key properties of N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide?
N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide has a molecular weight of 274.41 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide is sourced from PubChem (CID 62212541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).