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

C17H21ClN2O2 — CID 110822148

IUPAC2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)C2CCC2)CC1)c1ccccc1Cl
InChIInChI=1S/C17H21ClN2O2/c18-15-7-2-1-6-14(15)16(21)19-13-8-10-20(11-9-13)17(22)12-4-3-5-12/h1-2,6-7,12-13H,3-5,8-11H2,(H,19,21)
InChIKeyJUZTXEBDTFLZDC-UHFFFAOYSA-N
MW320.82 g/mol
LogP2.86
Rot. Bonds3

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

2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide (PubChem CID 110822148) has the molecular formula C17H21ClN2O2 and a molecular weight of 320.82 g/mol. Its IUPAC name is 2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide
PubChem CID110822148
Molecular FormulaC17H21ClN2O2
Molecular Weight320.82 g/mol
Exact Mass320.13
IUPAC Name2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)C2CCC2)CC1)c1ccccc1Cl
InChIInChI=1S/C17H21ClN2O2/c18-15-7-2-1-6-14(15)16(21)19-13-8-10-20(11-9-13)17(22)12-4-3-5-12/h1-2,6-7,12-13H,3-5,8-11H2,(H,19,21)
InChIKeyJUZTXEBDTFLZDC-UHFFFAOYSA-N
XLogP2.86
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.82
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide
CID 110819420
2-chloro-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]benzamide
CID 110819750
4-[(2-chlorobenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 51324372
methyl 4-[(2-chlorobenzoyl)amino]piperidine-1-carboxylate
CID 47392418
2-chloro-N-cyclopentylbenzamide
CID 669043
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide;hydrochloride
CID 119944177
N-[1-(cyclobutanecarbonyl)piperidin-4-yl]-4-phenylbenzamide
CID 52898200
N-(1-butanoylpiperidin-4-yl)-2-chlorobenzamide
CID 110819269
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-3-hydroxynaphthalene-2-carboxamide
CID 55690810
N-[1-(1-benzyl-5-oxopyrrolidine-3-carbonyl)piperidin-4-yl]-2-chlorobenzamide
CID 108550808
N-[1-(4-bromobenzoyl)piperidin-4-yl]-2-chlorobenzamide
CID 108550788
2-chloro-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 108550779

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide (CID 110822148) is 2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide is O=C(NC1CCN(C(=O)C2CCC2)CC1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide?
The InChIKey is JUZTXEBDTFLZDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21ClN2O2/c18-15-7-2-1-6-14(15)16(21)19-13-8-10-20(11-9-13)17(22)12-4-3-5-12/h1-2,6-7,12-13H,3-5,8-11H2,(H,19,21).
What are the key properties of 2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide?
2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide has a molecular weight of 320.82 g/mol, XLogP of 2.86, 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-(cyclobutanecarbonyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 110822148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).