5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide

C15H21ClN2O2 — CID 63636752

IUPAC5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide
SMILESCCCN(C(=O)c1cc(Cl)ccc1O)C1CCCNC1
InChIInChI=1S/C15H21ClN2O2/c1-2-8-18(12-4-3-7-17-10-12)15(20)13-9-11(16)5-6-14(13)19/h5-6,9,12,17,19H,2-4,7-8,10H2,1H3
InChIKeyGEFSYIPKSCOCHU-UHFFFAOYSA-N
MW296.80 g/mol
LogP2.65
Rot. Bonds4

About 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide

5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide (PubChem CID 63636752) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide
PubChem CID63636752
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC Name5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide
SMILESCCCN(C(=O)c1cc(Cl)ccc1O)C1CCCNC1
InChIInChI=1S/C15H21ClN2O2/c1-2-8-18(12-4-3-7-17-10-12)15(20)13-9-11(16)5-6-14(13)19/h5-6,9,12,17,19H,2-4,7-8,10H2,1H3
InChIKeyGEFSYIPKSCOCHU-UHFFFAOYSA-N
XLogP2.65
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-ethyl-2-fluoro-N-piperidin-3-ylbenzamide
CID 63637963
2-hydroxy-5-iodo-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 107732095
2-chloro-4-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 106862150
4-bromo-2-chloro-N-piperidin-3-yl-N-propylbenzamide
CID 63637268
5-chloro-N-(2-chloroethyl)-N-cyclopropyl-2-hydroxybenzamide
CID 55187434
N-(azetidin-3-yl)-5-chloro-2-iodo-N-propylbenzamide
CID 114030457
5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63050163
2-bromo-4-chloro-N-ethyl-N-piperidin-3-ylbenzamide
CID 107990350
4-fluoro-3-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63209531
5-chloro-N-cyclopentyl-2-hydroxy-N-(3-methylbutyl)benzamide
CID 112725848
N-(azepan-4-yl)-5-chloro-2-hydroxy-N-methylbenzamide
CID 107172538
3-(4-chlorophenyl)-1-piperidin-3-yl-1-propylurea
CID 63637628

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide (CID 63636752) is 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide is CCCN(C(=O)c1cc(Cl)ccc1O)C1CCCNC1.
What is the InChIKey of 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide?
The InChIKey is GEFSYIPKSCOCHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O2/c1-2-8-18(12-4-3-7-17-10-12)15(20)13-9-11(16)5-6-14(13)19/h5-6,9,12,17,19H,2-4,7-8,10H2,1H3.
What are the key properties of 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide?
5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide has a molecular weight of 296.80 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide is sourced from PubChem (CID 63636752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).