N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide

C23H22N2O2S — CID 70036807

IUPACN-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide
SMILESO=C(Nc1ccc(-c2ccc(C(=O)N3CCCCC3)s2)cc1)c1ccccc1
InChIInChI=1S/C23H22N2O2S/c26-22(18-7-3-1-4-8-18)24-19-11-9-17(10-12-19)20-13-14-21(28-20)23(27)25-15-5-2-6-16-25/h1,3-4,7-14H,2,5-6,15-16H2,(H,24,26)
InChIKeyNZXOWIXBGLQEAH-UHFFFAOYSA-N
MW390.51 g/mol
LogP5.29
Rot. Bonds4

About N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide

N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide (PubChem CID 70036807) has the molecular formula C23H22N2O2S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide.

Molecular Properties

Compound NameN-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide
PubChem CID70036807
Molecular FormulaC23H22N2O2S
Molecular Weight390.51 g/mol
Exact Mass390.14
IUPAC NameN-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide
SMILESO=C(Nc1ccc(-c2ccc(C(=O)N3CCCCC3)s2)cc1)c1ccccc1
InChIInChI=1S/C23H22N2O2S/c26-22(18-7-3-1-4-8-18)24-19-11-9-17(10-12-19)20-13-14-21(28-20)23(27)25-15-5-2-6-16-25/h1,3-4,7-14H,2,5-6,15-16H2,(H,24,26)
InChIKeyNZXOWIXBGLQEAH-UHFFFAOYSA-N
XLogP5.29
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.51
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(azepane-1-carbonyl)phenyl]benzamide
CID 17153241
5-[4-(4-methylpiperazine-1-carbonyl)phenyl]-N-phenylthiophene-2-carboxamide
CID 117091590
N-phenyl-4-(pyrrolidine-1-carbonyl)benzamide
CID 109044285
4-(phenylcarbamoylamino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 55532549
1-N,4-N-bis[4-(pyrrolidine-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 17196721
N,5-diphenylthiophene-2-carboxamide
CID 3746437
4-phenoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 55532346
N-[1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethyl]benzamide
CID 162698084
N-[4-(dimethylamino)-3-(piperidine-1-carbonyl)phenyl]-4-phenylbenzamide
CID 3877371
N-[4-(4-phenylphenyl)phenyl]benzamide
CID 59742294
3-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 2970403
3-amino-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 6939897

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide?
The IUPAC name of N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide (CID 70036807) is N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide.
What is the SMILES notation for N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide?
The canonical SMILES for N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide is O=C(Nc1ccc(-c2ccc(C(=O)N3CCCCC3)s2)cc1)c1ccccc1.
What is the InChIKey of N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide?
The InChIKey is NZXOWIXBGLQEAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O2S/c26-22(18-7-3-1-4-8-18)24-19-11-9-17(10-12-19)20-13-14-21(28-20)23(27)25-15-5-2-6-16-25/h1,3-4,7-14H,2,5-6,15-16H2,(H,24,26).
What are the key properties of N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide?
N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide has a molecular weight of 390.51 g/mol, XLogP of 5.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-(piperidine-1-carbonyl)thiophen-2-yl]phenyl]benzamide is sourced from PubChem (CID 70036807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).