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

C16H19ClN2O2 — CID 110819420

IUPAC2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)C2CC2)CC1)c1ccccc1Cl
InChIInChI=1S/C16H19ClN2O2/c17-14-4-2-1-3-13(14)15(20)18-12-7-9-19(10-8-12)16(21)11-5-6-11/h1-4,11-12H,5-10H2,(H,18,20)
InChIKeyGSUSZWOIYNJFEV-UHFFFAOYSA-N
MW306.79 g/mol
LogP2.47
Rot. Bonds3

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

2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide (PubChem CID 110819420) has the molecular formula C16H19ClN2O2 and a molecular weight of 306.79 g/mol. Its IUPAC name is 2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide
PubChem CID110819420
Molecular FormulaC16H19ClN2O2
Molecular Weight306.79 g/mol
Exact Mass306.11
IUPAC Name2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)C2CC2)CC1)c1ccccc1Cl
InChIInChI=1S/C16H19ClN2O2/c17-14-4-2-1-3-13(14)15(20)18-12-7-9-19(10-8-12)16(21)11-5-6-11/h1-4,11-12H,5-10H2,(H,18,20)
InChIKeyGSUSZWOIYNJFEV-UHFFFAOYSA-N
XLogP2.47
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.79
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide
CID 110822148
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide;hydrochloride
CID 119944177
4-[(2-chlorobenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 51324372
methyl 4-[(2-chlorobenzoyl)amino]piperidine-1-carboxylate
CID 47392418
2-chloro-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]benzamide
CID 110819750
N-(1-butanoylpiperidin-4-yl)-2-chlorobenzamide
CID 110819269
2-chloro-N-cyclopentylbenzamide
CID 669043
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
2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide
CID 108550866
2-chloro-N-[1-(furan-2-carbonyl)piperidin-4-yl]benzamide
CID 46420508

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide (CID 110819420) is 2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide is O=C(NC1CCN(C(=O)C2CC2)CC1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide?
The InChIKey is GSUSZWOIYNJFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O2/c17-14-4-2-1-3-13(14)15(20)18-12-7-9-19(10-8-12)16(21)11-5-6-11/h1-4,11-12H,5-10H2,(H,18,20).
What are the key properties of 2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide?
2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide has a molecular weight of 306.79 g/mol, XLogP of 2.47, 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-(cyclopropanecarbonyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 110819420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).