N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide

C22H21N3O2 — CID 3851641

IUPACN-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
SMILESO=C(NC1c2ccccc2-c2ccccc21)c1coc(C2CCNCC2)n1
InChIInChI=1S/C22H21N3O2/c26-21(19-13-27-22(24-19)14-9-11-23-12-10-14)25-20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1-8,13-14,20,23H,9-12H2,(H,25,26)
InChIKeyQKGSGNVMVQZMOD-UHFFFAOYSA-N
MW359.43 g/mol
LogP3.64
Rot. Bonds3

About N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide

N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide (PubChem CID 3851641) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
PubChem CID3851641
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC NameN-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
SMILESO=C(NC1c2ccccc2-c2ccccc21)c1coc(C2CCNCC2)n1
InChIInChI=1S/C22H21N3O2/c26-21(19-13-27-22(24-19)14-9-11-23-12-10-14)25-20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1-8,13-14,20,23H,9-12H2,(H,25,26)
InChIKeyQKGSGNVMVQZMOD-UHFFFAOYSA-N
XLogP3.64
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide
CID 5176278
N-cyclopropyl-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3864461
N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-thiazole-4-carboxamide
CID 3553057
N-(1-phenylethyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3868751
N-[(2-chlorophenyl)methyl]-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3785757
N-(3-bromophenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 5176443
N-(9H-fluoren-9-yl)-2-(methylaminomethyl)-1,3-oxazole-4-carboxamide
CID 3692959
N-(4-methoxyphenyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3857041
N-dodecyl-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3440443
N-heptyl-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3440445
2-piperidin-4-yl-N-[[2-(trifluoromethyl)phenyl]methyl]-1,3-oxazole-4-carboxamide
CID 3421131
N-heptan-2-yl-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3785755

Frequently Asked Questions

What is the IUPAC name of N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide (CID 3851641) is N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide is O=C(NC1c2ccccc2-c2ccccc21)c1coc(C2CCNCC2)n1.
What is the InChIKey of N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The InChIKey is QKGSGNVMVQZMOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c26-21(19-13-27-22(24-19)14-9-11-23-12-10-14)25-20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1-8,13-14,20,23H,9-12H2,(H,25,26).
What are the key properties of N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide?
N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide has a molecular weight of 359.43 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 3851641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).