N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide

C21H25N3O3 — CID 47836676

IUPACN-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
SMILESCOc1ccc(CCC(=O)N2CCC(NC(=O)c3cccnc3)CC2)cc1
InChIInChI=1S/C21H25N3O3/c1-27-19-7-4-16(5-8-19)6-9-20(25)24-13-10-18(11-14-24)23-21(26)17-3-2-12-22-15-17/h2-5,7-8,12,15,18H,6,9-11,13-14H2,1H3,(H,23,26)
InChIKeyRLTKTGZRWMCMGY-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.44
Rot. Bonds6

About N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide

N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide (PubChem CID 47836676) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
PubChem CID47836676
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC NameN-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
SMILESCOc1ccc(CCC(=O)N2CCC(NC(=O)c3cccnc3)CC2)cc1
InChIInChI=1S/C21H25N3O3/c1-27-19-7-4-16(5-8-19)6-9-20(25)24-13-10-18(11-14-24)23-21(26)17-3-2-12-22-15-17/h2-5,7-8,12,15,18H,6,9-11,13-14H2,1H3,(H,23,26)
InChIKeyRLTKTGZRWMCMGY-UHFFFAOYSA-N
XLogP2.44
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 47836658
N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]pyridine-3-carboxamide
CID 108548465
N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]-2,2-dimethylpropanamide
CID 110821944
N-[1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl]benzamide
CID 24575446
N-[1-(3-thiophen-2-ylpropanoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 110822080
ethyl [4-[[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]carbamoyl]phenyl] carbonate
CID 108930466
N-[1-(3-methylbutanoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47797205
N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]butanamide
CID 110821940
N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]cyclobutanecarboxamide
CID 110821946
N-[1-[4-(2,6-dimethylphenoxy)butanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 108548470
N-[[1-[3-(3,4-dimethoxyphenyl)propanoyl]piperidin-4-yl]methyl]pyridine-3-carboxamide
CID 108924721
N-[1-[2-[(4-ethoxybenzoyl)amino]acetyl]piperidin-4-yl]pyridine-3-carboxamide
CID 47836779

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide?
The IUPAC name of N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide (CID 47836676) is N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide is COc1ccc(CCC(=O)N2CCC(NC(=O)c3cccnc3)CC2)cc1.
What is the InChIKey of N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide?
The InChIKey is RLTKTGZRWMCMGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-27-19-7-4-16(5-8-19)6-9-20(25)24-13-10-18(11-14-24)23-21(26)17-3-2-12-22-15-17/h2-5,7-8,12,15,18H,6,9-11,13-14H2,1H3,(H,23,26).
What are the key properties of N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide?
N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide has a molecular weight of 367.45 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 47836676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).