4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide

C20H24N2O2 — CID 124566261

IUPAC4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide
SMILESCCOc1ccc(C(=O)Nc2ccc([C@H]3CCCNC3)cc2)cc1
InChIInChI=1S/C20H24N2O2/c1-2-24-19-11-7-16(8-12-19)20(23)22-18-9-5-15(6-10-18)17-4-3-13-21-14-17/h5-12,17,21H,2-4,13-14H2,1H3,(H,22,23)/t17-/m0/s1
InChIKeyKBBMDLQOJZSKSG-KRWDZBQOSA-N
MW324.42 g/mol
LogP3.80
Rot. Bonds5

About 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide

4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide (PubChem CID 124566261) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide
PubChem CID124566261
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide
SMILESCCOc1ccc(C(=O)Nc2ccc([C@H]3CCCNC3)cc2)cc1
InChIInChI=1S/C20H24N2O2/c1-2-24-19-11-7-16(8-12-19)20(23)22-18-9-5-15(6-10-18)17-4-3-13-21-14-17/h5-12,17,21H,2-4,13-14H2,1H3,(H,22,23)/t17-/m0/s1
InChIKeyKBBMDLQOJZSKSG-KRWDZBQOSA-N
XLogP3.80
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-[4-[(3S)-piperidin-3-yl]phenyl]benzamide
CID 124566433
N-(4-piperidin-3-ylphenyl)-4-propylbenzamide
CID 53251423
4-ethoxy-N-[4-[(2S)-morpholin-2-yl]phenyl]benzamide
CID 67239889
N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide
CID 67241110
N-ethyl-4-piperidin-3-ylbenzamide
CID 172654355
N-(4-cyclopentyloxyphenyl)-4-ethoxybenzamide
CID 36565370
2-[4-[(4-cyclobutylbenzoyl)amino]phenoxy]acetic acid
CID 120689771
4-chloro-N-[4-[(3S)-pyrrolidin-3-yl]phenyl]benzamide
CID 124561571
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide
CID 42989954
ethyl 4-[(3S)-piperidin-3-yl]benzoate
CID 176561746
4-ethynyl-N-(4-pyrrolidin-3-ylphenyl)benzamide
CID 53250757
4-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 13388921

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide?
The IUPAC name of 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide (CID 124566261) is 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide is CCOc1ccc(C(=O)Nc2ccc([C@H]3CCCNC3)cc2)cc1.
What is the InChIKey of 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide?
The InChIKey is KBBMDLQOJZSKSG-KRWDZBQOSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-2-24-19-11-7-16(8-12-19)20(23)22-18-9-5-15(6-10-18)17-4-3-13-21-14-17/h5-12,17,21H,2-4,13-14H2,1H3,(H,22,23)/t17-/m0/s1.
What are the key properties of 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide?
4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide has a molecular weight of 324.42 g/mol, XLogP of 3.80, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide is sourced from PubChem (CID 124566261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).