N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide

C14H18ClN3O2 — CID 18133860

IUPACN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide
SMILESNC(=O)CN1CCC(NC(=O)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C14H18ClN3O2/c15-11-3-1-10(2-4-11)14(20)17-12-5-7-18(8-6-12)9-13(16)19/h1-4,12H,5-9H2,(H2,16,19)(H,17,20)
InChIKeyZBULIWBWJGNBRM-UHFFFAOYSA-N
MW295.77 g/mol
LogP1.02
Rot. Bonds4

About N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide

N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide (PubChem CID 18133860) has the molecular formula C14H18ClN3O2 and a molecular weight of 295.77 g/mol. Its IUPAC name is N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide.

Molecular Properties

Compound NameN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide
PubChem CID18133860
Molecular FormulaC14H18ClN3O2
Molecular Weight295.77 g/mol
Exact Mass295.11
IUPAC NameN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide
SMILESNC(=O)CN1CCC(NC(=O)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C14H18ClN3O2/c15-11-3-1-10(2-4-11)14(20)17-12-5-7-18(8-6-12)9-13(16)19/h1-4,12H,5-9H2,(H2,16,19)(H,17,20)
InChIKeyZBULIWBWJGNBRM-UHFFFAOYSA-N
XLogP1.02
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyanobenzamide
CID 24674040
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-chloro-2-hydroxybenzamide
CID 134047749
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-cyclohexylbenzamide
CID 46687376
2-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-chlorobenzamide
CID 61140773
N-[1-[[1-(2-amino-2-oxoethyl)piperidin-4-yl]amino]-3-methyl-1-oxopentan-2-yl]-4-chlorobenzamide
CID 134047768
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropanecarbonylamino)benzamide
CID 134047720
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide
CID 18278929
N-[1-(2-amino-2-sulfanylideneethyl)piperidin-4-yl]-4-iodobenzamide
CID 63627321
3-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]benzamide
CID 43711659
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chloropyridine-2-carboxamide
CID 60707818
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-(chloromethyl)benzamide
CID 43700629
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2,6-dichloropyridine-3-carboxamide
CID 106993304

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide?
The IUPAC name of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide (CID 18133860) is N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide.
What is the SMILES notation for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide?
The canonical SMILES for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide is NC(=O)CN1CCC(NC(=O)c2ccc(Cl)cc2)CC1.
What is the InChIKey of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide?
The InChIKey is ZBULIWBWJGNBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN3O2/c15-11-3-1-10(2-4-11)14(20)17-12-5-7-18(8-6-12)9-13(16)19/h1-4,12H,5-9H2,(H2,16,19)(H,17,20).
What are the key properties of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide?
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide has a molecular weight of 295.77 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide is sourced from PubChem (CID 18133860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).