4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide

C13H17ClN2O2 — CID 102954421

IUPAC4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide
SMILESCC1CCNCC1Oc1cc(Cl)ccc1C(N)=O
InChIInChI=1S/C13H17ClN2O2/c1-8-4-5-16-7-12(8)18-11-6-9(14)2-3-10(11)13(15)17/h2-3,6,8,12,16H,4-5,7H2,1H3,(H2,15,17)
InChIKeyDXSVXGOVFFQOFG-UHFFFAOYSA-N
MW268.74 g/mol
LogP1.82
Rot. Bonds3

About 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide

4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide (PubChem CID 102954421) has the molecular formula C13H17ClN2O2 and a molecular weight of 268.74 g/mol. Its IUPAC name is 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide.

Molecular Properties

Compound Name4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide
PubChem CID102954421
Molecular FormulaC13H17ClN2O2
Molecular Weight268.74 g/mol
Exact Mass268.10
IUPAC Name4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide
SMILESCC1CCNCC1Oc1cc(Cl)ccc1C(N)=O
InChIInChI=1S/C13H17ClN2O2/c1-8-4-5-16-7-12(8)18-11-6-9(14)2-3-10(11)13(15)17/h2-3,6,8,12,16H,4-5,7H2,1H3,(H2,15,17)
InChIKeyDXSVXGOVFFQOFG-UHFFFAOYSA-N
XLogP1.82
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.74
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-methylpiperidin-3-yl)oxypyridine-2-carboxamide
CID 102954424
5-chloro-2-[(3S)-piperidin-3-yl]oxybenzamide
CID 66246605
4-chloro-2-methoxybenzamide
CID 19741766
2-[(4-methylpiperidin-3-yl)oxymethyl]benzamide
CID 102954062
5-chloro-2-(2-pyrrolidin-3-ylethoxy)benzamide
CID 114796482
4-chloro-2-(3-pyrrolidin-3-yloxyphenyl)benzamide
CID 67250566
2-chloro-4-pyrrolidin-3-yloxybenzamide
CID 62945417
4-chloro-2-ethoxybenzamide
CID 126998915
(5-chloro-2-methoxyphenyl)-pyrrolidin-3-ylmethanone
CID 116568381
5-chloro-2-(piperidin-4-ylmethoxy)benzamide
CID 62493382
4-chloro-2-methoxy-N-piperidin-3-ylbenzamide
CID 63321384
4-chloro-2-(2-pyrrolidin-3-ylethylamino)benzamide
CID 63623817

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide?
The IUPAC name of 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide (CID 102954421) is 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide.
What is the SMILES notation for 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide?
The canonical SMILES for 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide is CC1CCNCC1Oc1cc(Cl)ccc1C(N)=O.
What is the InChIKey of 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide?
The InChIKey is DXSVXGOVFFQOFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O2/c1-8-4-5-16-7-12(8)18-11-6-9(14)2-3-10(11)13(15)17/h2-3,6,8,12,16H,4-5,7H2,1H3,(H2,15,17).
What are the key properties of 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide?
4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide has a molecular weight of 268.74 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(4-methylpiperidin-3-yl)oxybenzamide is sourced from PubChem (CID 102954421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).