3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide

C21H24N2O3 — CID 108550302

IUPAC3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide
SMILESCOc1cccc(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)c1
InChIInChI=1S/C21H24N2O3/c1-15-6-8-16(9-7-15)21(25)23-12-10-18(11-13-23)22-20(24)17-4-3-5-19(14-17)26-2/h3-9,14,18H,10-13H2,1-2H3,(H,22,24)
InChIKeyUYFGSOMGMLDTHT-UHFFFAOYSA-N
MW352.43 g/mol
LogP3.04
Rot. Bonds4

About 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide

3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide (PubChem CID 108550302) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide
PubChem CID108550302
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide
SMILESCOc1cccc(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)c1
InChIInChI=1S/C21H24N2O3/c1-15-6-8-16(9-7-15)21(25)23-12-10-18(11-13-23)22-20(24)17-4-3-5-19(14-17)26-2/h3-9,14,18H,10-13H2,1-2H3,(H,22,24)
InChIKeyUYFGSOMGMLDTHT-UHFFFAOYSA-N
XLogP3.04
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-tert-butylbenzoyl)piperidin-4-yl]-3-methoxybenzamide
CID 108550355
3-hydroxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108558264
N-[1-[4-(3-methoxyphenyl)benzoyl]piperidin-4-yl]benzamide
CID 134801898
N-[1-(furan-3-carbonyl)piperidin-4-yl]-3-methoxybenzamide
CID 38022754
3-amino-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide;hydrochloride
CID 119770082
2-methoxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108549181
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-3-methoxybenzamide
CID 110819864
N-cyclopropyl-3-methoxybenzamide
CID 900156
3-methoxy-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]benzamide
CID 47029925
N-[1-[(2,5-dimethylphenyl)carbamothioyl]piperidin-4-yl]-3-methoxybenzamide
CID 43814150
[3-[4-[(3-methylbenzoyl)amino]piperidine-1-carbonyl]phenyl] acetate
CID 108555308
N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]-3-methoxybenzamide
CID 108550325

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide?
The IUPAC name of 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide (CID 108550302) is 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide?
The canonical SMILES for 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide is COc1cccc(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)c1.
What is the InChIKey of 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide?
The InChIKey is UYFGSOMGMLDTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-15-6-8-16(9-7-15)21(25)23-12-10-18(11-13-23)22-20(24)17-4-3-5-19(14-17)26-2/h3-9,14,18H,10-13H2,1-2H3,(H,22,24).
What are the key properties of 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide?
3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide has a molecular weight of 352.43 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 108550302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).