N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide

C17H26N2O — CID 62365720

IUPACN-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide
SMILESCCN(C(=O)CCc1cccc(C)c1)C1CCNCC1
InChIInChI=1S/C17H26N2O/c1-3-19(16-9-11-18-12-10-16)17(20)8-7-15-6-4-5-14(2)13-15/h4-6,13,16,18H,3,7-12H2,1-2H3
InChIKeyLLMMDCYGBROSHV-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.53
Rot. Bonds5

About N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide

N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide (PubChem CID 62365720) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide
PubChem CID62365720
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide
SMILESCCN(C(=O)CCc1cccc(C)c1)C1CCNCC1
InChIInChI=1S/C17H26N2O/c1-3-19(16-9-11-18-12-10-16)17(20)8-7-15-6-4-5-14(2)13-15/h4-6,13,16,18H,3,7-12H2,1-2H3
InChIKeyLLMMDCYGBROSHV-UHFFFAOYSA-N
XLogP2.53
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 ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-(3-methylphenyl)-N-(2-piperidin-4-ylethyl)propanamide
CID 62366566
N,N-diethyl-3-(3-methylphenyl)propanamide
CID 60701900
N-cyclopropyl-3-(3-fluorophenyl)-N-[(3-methylphenyl)methyl]propanamide
CID 78851901
3-(3-nitrophenyl)-N-piperidin-4-yl-N-propylpropanamide
CID 119823365
2-(3-methylphenyl)-N-propyl-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 94420232
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-3-(3-methylphenyl)propanamide
CID 62366416
3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119825837
N-cyclohexyl-N-ethyl-3-phenylpropanamide
CID 670110
3-(3-methylphenyl)-N-(pyrrolidin-3-ylmethyl)propanamide
CID 80563288
N-methyl-N-[(3-methylphenyl)methyl]-3-piperidin-4-ylpropanamide
CID 62210732
N-ethyl-N-[(3-methylphenyl)methyl]-2-piperidin-4-yloxyacetamide
CID 63876380
N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
CID 60807085

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide?
The IUPAC name of N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide (CID 62365720) is N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide.
What is the SMILES notation for N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide?
The canonical SMILES for N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide is CCN(C(=O)CCc1cccc(C)c1)C1CCNCC1.
What is the InChIKey of N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide?
The InChIKey is LLMMDCYGBROSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-19(16-9-11-18-12-10-16)17(20)8-7-15-6-4-5-14(2)13-15/h4-6,13,16,18H,3,7-12H2,1-2H3.
What are the key properties of N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide?
N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide has a molecular weight of 274.41 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-methylphenyl)-N-piperidin-4-ylpropanamide is sourced from PubChem (CID 62365720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).