2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide

C20H28ClN3O2 — CID 54815159

IUPAC2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide
SMILESO=C(CN1CCCCC1)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C20H28ClN3O2/c21-18-10-9-16(22-19(25)14-24-11-5-2-6-12-24)13-17(18)20(26)23-15-7-3-1-4-8-15/h9-10,13,15H,1-8,11-12,14H2,(H,22,25)(H,23,26)
InChIKeyXAQQXHNVEGPVGH-UHFFFAOYSA-N
MW377.92 g/mol
LogP3.83
Rot. Bonds5

About 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide

2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide (PubChem CID 54815159) has the molecular formula C20H28ClN3O2 and a molecular weight of 377.92 g/mol. Its IUPAC name is 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide.

Molecular Properties

Compound Name2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide
PubChem CID54815159
Molecular FormulaC20H28ClN3O2
Molecular Weight377.92 g/mol
Exact Mass377.19
IUPAC Name2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide
SMILESO=C(CN1CCCCC1)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C20H28ClN3O2/c21-18-10-9-16(22-19(25)14-24-11-5-2-6-12-24)13-17(18)20(26)23-15-7-3-1-4-8-15/h9-10,13,15H,1-8,11-12,14H2,(H,22,25)(H,23,26)
InChIKeyXAQQXHNVEGPVGH-UHFFFAOYSA-N
XLogP3.83
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.92
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-1-[2-(3,4-dichloroanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 16909920
2-chloro-N-cyclopentyl-5-(propanoylamino)benzamide
CID 50875940
2-chloro-N-cyclohexyl-5-(cyclohexylcarbamoylamino)benzamide
CID 17188470
2-chloro-N-cyclohexyl-5-[[2-(prop-2-enylamino)acetyl]amino]benzamide
CID 54818353
2-chloro-N-cyclohexyl-5-[4-(methylamino)butanoylamino]benzamide
CID 119743114
2-chloro-N-cyclohexyl-5-(hexanoylamino)benzamide
CID 17188521
2-(azepan-1-yl)-N-(3-chloro-4-methylphenyl)acetamide
CID 8895979
2-chloro-N-cyclohexyl-5-[[2-(2,5-dichloroanilino)acetyl]amino]benzamide
CID 54819816
N-(3-amino-4-chlorophenyl)-2-(azepan-1-yl)acetamide
CID 16779269
2-chloro-N-cyclohexyl-5-[[2-(4-phenylphenoxy)acetyl]amino]benzamide
CID 17188486
5-[[2-[3-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]-2-chloro-N-cyclohexylbenzamide
CID 54833251
2-chloro-N-cyclohexyl-5-(phenylcarbamoylamino)benzamide
CID 17188425

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide?
The IUPAC name of 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide (CID 54815159) is 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide.
What is the SMILES notation for 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide?
The canonical SMILES for 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide is O=C(CN1CCCCC1)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1.
What is the InChIKey of 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide?
The InChIKey is XAQQXHNVEGPVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28ClN3O2/c21-18-10-9-16(22-19(25)14-24-11-5-2-6-12-24)13-17(18)20(26)23-15-7-3-1-4-8-15/h9-10,13,15H,1-8,11-12,14H2,(H,22,25)(H,23,26).
What are the key properties of 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide?
2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide has a molecular weight of 377.92 g/mol, XLogP of 3.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-cyclohexyl-5-[(2-piperidin-1-ylacetyl)amino]benzamide is sourced from PubChem (CID 54815159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).