2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide

C19H17Cl2FN2O2 — CID 108550866

IUPAC2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1ccccc1Cl
InChIInChI=1S/C19H17Cl2FN2O2/c20-14-5-2-1-4-13(14)18(25)23-12-8-10-24(11-9-12)19(26)17-15(21)6-3-7-16(17)22/h1-7,12H,8-11H2,(H,23,25)
InChIKeyQKLDPBZXUCNZNS-UHFFFAOYSA-N
MW395.26 g/mol
LogP4.17
Rot. Bonds3

About 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide

2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide (PubChem CID 108550866) has the molecular formula C19H17Cl2FN2O2 and a molecular weight of 395.26 g/mol. Its IUPAC name is 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide
PubChem CID108550866
Molecular FormulaC19H17Cl2FN2O2
Molecular Weight395.26 g/mol
Exact Mass394.07
IUPAC Name2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1ccccc1Cl
InChIInChI=1S/C19H17Cl2FN2O2/c20-14-5-2-1-4-13(14)18(25)23-12-8-10-24(11-9-12)19(26)17-15(21)6-3-7-16(17)22/h1-7,12H,8-11H2,(H,23,25)
InChIKeyQKLDPBZXUCNZNS-UHFFFAOYSA-N
XLogP4.17
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.26
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide
CID 108567325
2,2-dichloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]acetamide
CID 108567322
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108558235
2-chloro-6-fluoro-N-[1-(2-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108558620
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 110821572
2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 108567332
2-chloro-N-[1-(2-fluorobenzoyl)piperidin-4-yl]-6-(trifluoromethyl)benzamide
CID 166358082
2-chloro-6-fluoro-N-[2-[4-[(2-fluorobenzoyl)amino]piperidin-1-yl]-2-oxoethyl]benzamide
CID 86898999
2-chloro-6-fluoro-N-[1-(3-fluorobenzoyl)piperidin-4-yl]benzamide
CID 108558699
4-[(2-chlorobenzoyl)amino]-N-(2-fluorophenyl)piperidine-1-carboxamide
CID 3218437
1-(2-chloro-6-fluorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
CID 113003080
2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide
CID 110819420

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide (CID 108550866) is 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide is O=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide?
The InChIKey is QKLDPBZXUCNZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17Cl2FN2O2/c20-14-5-2-1-4-13(14)18(25)23-12-8-10-24(11-9-12)19(26)17-15(21)6-3-7-16(17)22/h1-7,12H,8-11H2,(H,23,25).
What are the key properties of 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide?
2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide has a molecular weight of 395.26 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 108550866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).