3-(4-piperidin-1-ylphenyl)benzamide

C18H20N2O — CID 68760605

IUPAC3-(4-piperidin-1-ylphenyl)benzamide
SMILESNC(=O)c1cccc(-c2ccc(N3CCCCC3)cc2)c1
InChIInChI=1S/C18H20N2O/c19-18(21)16-6-4-5-15(13-16)14-7-9-17(10-8-14)20-11-2-1-3-12-20/h4-10,13H,1-3,11-12H2,(H2,19,21)
InChIKeyUEXQAYRLXUJPTF-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.44
Rot. Bonds3

About 3-(4-piperidin-1-ylphenyl)benzamide

3-(4-piperidin-1-ylphenyl)benzamide (PubChem CID 68760605) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 3-(4-piperidin-1-ylphenyl)benzamide.

Molecular Properties

Compound Name3-(4-piperidin-1-ylphenyl)benzamide
PubChem CID68760605
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name3-(4-piperidin-1-ylphenyl)benzamide
SMILESNC(=O)c1cccc(-c2ccc(N3CCCCC3)cc2)c1
InChIInChI=1S/C18H20N2O/c19-18(21)16-6-4-5-15(13-16)14-7-9-17(10-8-14)20-11-2-1-3-12-20/h4-10,13H,1-3,11-12H2,(H2,19,21)
InChIKeyUEXQAYRLXUJPTF-UHFFFAOYSA-N
XLogP3.44
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-(4-pyrrolidin-1-ylphenyl)benzamide
CID 168513530
3-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 71189662
3-(2,5-dihydropyrrol-1-yl)benzamide
CID 90286995
4-(3-carbamoylphenyl)benzoate
CID 86307207
3-(azecane-1-carbonyl)benzamide
CID 66696565
3-piperidin-1-ylbenzenecarbothioamide
CID 39244570
3-(azacyclotridecane-1-carbonyl)benzamide;benzene-1,3-dicarboxamide
CID 66718983
carbamic acid;1-phenylpiperidine
CID 161473217
3-[4-[1-(methylamino)-2-pyrrolidin-1-ylethyl]phenyl]benzamide
CID 76542594
3-phenylbenzamide;phosphoric acid
CID 130454344
azepan-1-yl-[3-(4-methylphenyl)phenyl]methanone
CID 126484488
4-(4-piperidin-1-ylphenyl)aniline
CID 45277459

Frequently Asked Questions

What is the IUPAC name of 3-(4-piperidin-1-ylphenyl)benzamide?
The IUPAC name of 3-(4-piperidin-1-ylphenyl)benzamide (CID 68760605) is 3-(4-piperidin-1-ylphenyl)benzamide.
What is the SMILES notation for 3-(4-piperidin-1-ylphenyl)benzamide?
The canonical SMILES for 3-(4-piperidin-1-ylphenyl)benzamide is NC(=O)c1cccc(-c2ccc(N3CCCCC3)cc2)c1.
What is the InChIKey of 3-(4-piperidin-1-ylphenyl)benzamide?
The InChIKey is UEXQAYRLXUJPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c19-18(21)16-6-4-5-15(13-16)14-7-9-17(10-8-14)20-11-2-1-3-12-20/h4-10,13H,1-3,11-12H2,(H2,19,21).
What are the key properties of 3-(4-piperidin-1-ylphenyl)benzamide?
3-(4-piperidin-1-ylphenyl)benzamide has a molecular weight of 280.37 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-piperidin-1-ylphenyl)benzamide is sourced from PubChem (CID 68760605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).