N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide

C19H20ClN3O2 — CID 108924893

IUPACN-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide
SMILESO=C(NC1CCN(C(=O)Cc2cccc(Cl)c2)CC1)c1cccnc1
InChIInChI=1S/C19H20ClN3O2/c20-16-5-1-3-14(11-16)12-18(24)23-9-6-17(7-10-23)22-19(25)15-4-2-8-21-13-15/h1-5,8,11,13,17H,6-7,9-10,12H2,(H,22,25)
InChIKeyFOCYNEFKXKLOJC-UHFFFAOYSA-N
MW357.84 g/mol
LogP2.70
Rot. Bonds4

About N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide

N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide (PubChem CID 108924893) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide
PubChem CID108924893
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC NameN-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide
SMILESO=C(NC1CCN(C(=O)Cc2cccc(Cl)c2)CC1)c1cccnc1
InChIInChI=1S/C19H20ClN3O2/c20-16-5-1-3-14(11-16)12-18(24)23-9-6-17(7-10-23)22-19(25)15-4-2-8-21-13-15/h1-5,8,11,13,17H,6-7,9-10,12H2,(H,22,25)
InChIKeyFOCYNEFKXKLOJC-UHFFFAOYSA-N
XLogP2.70
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[2-(3-bromophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide
CID 108924895
N-[1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 47836658
N-[1-(3-methylbutanoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47797205
N-[1-(benzylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47836760
N-[1-(2-chlorobenzoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47797182
[3-[[1-[3-(3-chlorophenyl)propanoyl]piperidin-4-yl]carbamoyl]phenyl] acetate
CID 108927499
N-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]pyridine-3-carboxamide
CID 175648718
N-[1-(4-cyclohexylbutanoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47076419
N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 47836676
N-[1-(3-thiophen-2-ylpropanoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 110822080
N-[1-[4-(2,6-dimethylphenoxy)butanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 108548470
N-[1-[4-(pyrazol-1-ylmethyl)benzoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 47836552

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide?
The IUPAC name of N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide (CID 108924893) is N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide is O=C(NC1CCN(C(=O)Cc2cccc(Cl)c2)CC1)c1cccnc1.
What is the InChIKey of N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide?
The InChIKey is FOCYNEFKXKLOJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2/c20-16-5-1-3-14(11-16)12-18(24)23-9-6-17(7-10-23)22-19(25)15-4-2-8-21-13-15/h1-5,8,11,13,17H,6-7,9-10,12H2,(H,22,25).
What are the key properties of N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide?
N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide has a molecular weight of 357.84 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 108924893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).