N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide

C17H26N2O2 — CID 63903931

IUPACN-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide
SMILESCc1cccc(CCNC(=O)CCOC2CCNCC2)c1
InChIInChI=1S/C17H26N2O2/c1-14-3-2-4-15(13-14)5-11-19-17(20)8-12-21-16-6-9-18-10-7-16/h2-4,13,16,18H,5-12H2,1H3,(H,19,20)
InChIKeyCLUAKMKSTPQMMW-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.81
Rot. Bonds7

About N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide

N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide (PubChem CID 63903931) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide
PubChem CID63903931
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide
SMILESCc1cccc(CCNC(=O)CCOC2CCNCC2)c1
InChIInChI=1S/C17H26N2O2/c1-14-3-2-4-15(13-14)5-11-19-17(20)8-12-21-16-6-9-18-10-7-16/h2-4,13,16,18H,5-12H2,1H3,(H,19,20)
InChIKeyCLUAKMKSTPQMMW-UHFFFAOYSA-N
XLogP1.81
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylphenyl)-3-piperidin-4-yloxypropanamide
CID 63875437
N-(2-phenylethyl)-2-piperidin-4-yloxyacetamide
CID 63877044
N-[2-(3-methylphenyl)ethyl]-3-piperidin-2-ylpropanamide
CID 62315398
N-[2-(3-methylphenyl)ethyl]-2-piperidin-3-ylacetamide
CID 62690046
3-[2-[3-(oxan-4-yloxy)propanoylamino]ethyl]benzoic acid
CID 120535508
3-(3-methylphenyl)-N-(pyrrolidin-3-ylmethyl)propanamide
CID 80563288
3-(3-methylphenyl)-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]propanamide
CID 104971869
3-acetamido-N-[2-(3-methylphenyl)ethyl]propanamide
CID 110354308
4-[(3-methylphenyl)methoxy]piperidine;hydrochloride
CID 45075442
N-[2-(3-methylphenyl)ethyl]-4-phenoxybutanamide
CID 110288608
5-[2-(3-methylphenyl)ethylamino]-5-oxopentanoic acid
CID 62314996
2-methyl-N-[2-(3-piperidin-4-yloxypropanoylamino)ethyl]propanamide
CID 63904487

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide (CID 63903931) is N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide is Cc1cccc(CCNC(=O)CCOC2CCNCC2)c1.
What is the InChIKey of N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide?
The InChIKey is CLUAKMKSTPQMMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-14-3-2-4-15(13-14)5-11-19-17(20)8-12-21-16-6-9-18-10-7-16/h2-4,13,16,18H,5-12H2,1H3,(H,19,20).
What are the key properties of N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide?
N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide has a molecular weight of 290.41 g/mol, XLogP of 1.81, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methylphenyl)ethyl]-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 63903931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).