N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide

C21H26N2O3 — CID 33103457

IUPACN-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide
SMILESCOc1ccc(OCCN2CCC(NC(=O)c3ccccc3)CC2)cc1
InChIInChI=1S/C21H26N2O3/c1-25-19-7-9-20(10-8-19)26-16-15-23-13-11-18(12-14-23)22-21(24)17-5-3-2-4-6-17/h2-10,18H,11-16H2,1H3,(H,22,24)
InChIKeyYLBAXNNXRFOQSP-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.97
Rot. Bonds7

About N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide

N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide (PubChem CID 33103457) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide
PubChem CID33103457
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC NameN-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide
SMILESCOc1ccc(OCCN2CCC(NC(=O)c3ccccc3)CC2)cc1
InChIInChI=1S/C21H26N2O3/c1-25-19-7-9-20(10-8-19)26-16-15-23-13-11-18(12-14-23)22-21(24)17-5-3-2-4-6-17/h2-10,18H,11-16H2,1H3,(H,22,24)
InChIKeyYLBAXNNXRFOQSP-UHFFFAOYSA-N
XLogP2.97
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-benzylpiperidin-4-yl)-4-methoxybenzamide
CID 799331
N-(1-benzylpiperidin-4-yl)-4-(2-methoxyethoxy)benzamide
CID 17176539
N-[1-[2-[4-(1,3-benzothiazol-2-yloxy)phenoxy]ethyl]piperidin-4-yl]benzamide
CID 11248476
3-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]benzamide
CID 71784695
N-[1-[2-(2,6-dichlorophenoxy)ethyl]piperidin-4-yl]benzamide
CID 33104635
N-[1-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]piperidin-4-yl]benzamide
CID 33102925
N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzenesulfonamide
CID 18137019
N-[1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide
CID 33104690
N-[2-(4-methoxyphenyl)ethyl]-1-(2-phenoxyethyl)piperidine-4-carboxamide
CID 11036347
4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide
CID 108548897
4-(4-methoxyphenoxy)-N-(1-propylpiperidin-4-yl)butanamide
CID 86907108
4-fluoro-N-[1-(2-methoxyethyl)piperidin-4-yl]benzamide
CID 34797820

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide?
The IUPAC name of N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide (CID 33103457) is N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide.
What is the SMILES notation for N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide?
The canonical SMILES for N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide is COc1ccc(OCCN2CCC(NC(=O)c3ccccc3)CC2)cc1.
What is the InChIKey of N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide?
The InChIKey is YLBAXNNXRFOQSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-25-19-7-9-20(10-8-19)26-16-15-23-13-11-18(12-14-23)22-21(24)17-5-3-2-4-6-17/h2-10,18H,11-16H2,1H3,(H,22,24).
What are the key properties of N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide?
N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide has a molecular weight of 354.45 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide is sourced from PubChem (CID 33103457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).