N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide

C16H19N3O3 — CID 3857041

IUPACN-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
SMILESCOc1ccc(NC(=O)c2coc(C3CCNCC3)n2)cc1
InChIInChI=1S/C16H19N3O3/c1-21-13-4-2-12(3-5-13)18-15(20)14-10-22-16(19-14)11-6-8-17-9-7-11/h2-5,10-11,17H,6-9H2,1H3,(H,18,20)
InChIKeyBVZONAFFCXIPAM-UHFFFAOYSA-N
MW301.35 g/mol
LogP2.40
Rot. Bonds4

About N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide

N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide (PubChem CID 3857041) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
PubChem CID3857041
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
SMILESCOc1ccc(NC(=O)c2coc(C3CCNCC3)n2)cc1
InChIInChI=1S/C16H19N3O3/c1-21-13-4-2-12(3-5-13)18-15(20)14-10-22-16(19-14)11-6-8-17-9-7-11/h2-5,10-11,17H,6-9H2,1H3,(H,18,20)
InChIKeyBVZONAFFCXIPAM-UHFFFAOYSA-N
XLogP2.40
TPSA76.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(4-aminophenyl)methyl]phenyl]-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3860536
N-(3-bromophenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 5176443
2-cyclobutyl-N-[1-[2-(4-methoxyanilino)-2-oxoethyl]pyrazol-4-yl]-1,3-oxazole-4-carboxamide
CID 126784378
N-cyclopropyl-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3864461
2-(oxan-4-yl)-N-(1H-pyrazol-4-yl)-1,3-oxazole-4-carboxamide
CID 127905949
N-dodecyl-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3440443
N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3851641
N-[2-(4-methoxyphenyl)ethyl]-2-piperidin-3-yl-1,3-oxazole-4-carboxamide
CID 3868746
N,1-bis(4-methoxyphenyl)-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20953785
N-[(2-chlorophenyl)methyl]-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3785757
N-heptan-2-yl-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3785755
N-(6-carbamoyl-3-pyridinyl)-2-cyclobutyl-1,3-oxazole-4-carboxamide
CID 126784346

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide (CID 3857041) is N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide is COc1ccc(NC(=O)c2coc(C3CCNCC3)n2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The InChIKey is BVZONAFFCXIPAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-21-13-4-2-12(3-5-13)18-15(20)14-10-22-16(19-14)11-6-8-17-9-7-11/h2-5,10-11,17H,6-9H2,1H3,(H,18,20).
What are the key properties of N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide?
N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 3857041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).