2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide

C19H26ClN3O2 — CID 135119763

IUPAC2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide
SMILESNC(=O)CC1CCCCN1C(=O)c1cc(N2CCCCC2)ccc1Cl
InChIInChI=1S/C19H26ClN3O2/c20-17-8-7-14(22-9-3-1-4-10-22)12-16(17)19(25)23-11-5-2-6-15(23)13-18(21)24/h7-8,12,15H,1-6,9-11,13H2,(H2,21,24)
InChIKeyARYRRIREGAVUGH-UHFFFAOYSA-N
MW363.89 g/mol
LogP3.20
Rot. Bonds4

About 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide

2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide (PubChem CID 135119763) has the molecular formula C19H26ClN3O2 and a molecular weight of 363.89 g/mol. Its IUPAC name is 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide.

Molecular Properties

Compound Name2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide
PubChem CID135119763
Molecular FormulaC19H26ClN3O2
Molecular Weight363.89 g/mol
Exact Mass363.17
IUPAC Name2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide
SMILESNC(=O)CC1CCCCN1C(=O)c1cc(N2CCCCC2)ccc1Cl
InChIInChI=1S/C19H26ClN3O2/c20-17-8-7-14(22-9-3-1-4-10-22)12-16(17)19(25)23-11-5-2-6-15(23)13-18(21)24/h7-8,12,15H,1-6,9-11,13H2,(H2,21,24)
InChIKeyARYRRIREGAVUGH-UHFFFAOYSA-N
XLogP3.20
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.89
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2R)-1-(3-chloro-5-fluoro-2-hydroxybenzoyl)piperidin-2-yl]acetamide
CID 97250942
2-[(2R)-1-(2-bromo-5-fluorobenzoyl)piperidin-2-yl]acetamide
CID 95309748
(5-bromo-2-chlorophenyl)-(2-ethylazepan-1-yl)methanone
CID 113441714
2-[(2R)-1-(4-pyrrol-1-ylbenzoyl)piperidin-2-yl]acetamide
CID 94818861
(2-chloro-5-hydroxyphenyl)-(2-ethylpiperidin-1-yl)methanone
CID 106501379
2-[(2R)-1-(2,3-dihydro-1H-indene-5-carbonyl)piperidin-2-yl]acetamide
CID 95293673
2-[1-(5-bromo-2-chlorobenzoyl)pyrrolidin-2-yl]acetic acid
CID 61370095
1-[1-(5-chloro-2-fluorobenzoyl)azepan-2-yl]propan-2-one
CID 79540783
1-[1-(2-chloro-4-methylbenzoyl)piperidin-2-yl]propan-2-one
CID 106861332
2-[1-[3-chloro-5-(trifluoromethyl)benzoyl]piperidin-2-yl]acetamide
CID 91649837
2-[(2R)-1-[3-(azepan-1-ylmethyl)benzoyl]piperidin-2-yl]acetamide
CID 28785398
[2-(aminomethyl)piperidin-1-yl]-(2-chloro-4,5-difluorophenyl)methanone;hydrochloride
CID 119468475

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide?
The IUPAC name of 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide (CID 135119763) is 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide.
What is the SMILES notation for 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide?
The canonical SMILES for 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide is NC(=O)CC1CCCCN1C(=O)c1cc(N2CCCCC2)ccc1Cl.
What is the InChIKey of 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide?
The InChIKey is ARYRRIREGAVUGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26ClN3O2/c20-17-8-7-14(22-9-3-1-4-10-22)12-16(17)19(25)23-11-5-2-6-15(23)13-18(21)24/h7-8,12,15H,1-6,9-11,13H2,(H2,21,24).
What are the key properties of 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide?
2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide has a molecular weight of 363.89 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-chloro-5-piperidin-1-ylbenzoyl)piperidin-2-yl]acetamide is sourced from PubChem (CID 135119763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).