N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide

C21H20FN3O2 — CID 46970583

IUPACN-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(c1cc(-c2ccc(F)cc2)on1)N(Cc1ccccn1)C1CCCC1
InChIInChI=1S/C21H20FN3O2/c22-16-10-8-15(9-11-16)20-13-19(24-27-20)21(26)25(18-6-1-2-7-18)14-17-5-3-4-12-23-17/h3-5,8-13,18H,1-2,6-7,14H2
InChIKeyUEOTWRVTZKMQJQ-UHFFFAOYSA-N
MW365.41 g/mol
LogP4.46
Rot. Bonds5

About N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide

N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide (PubChem CID 46970583) has the molecular formula C21H20FN3O2 and a molecular weight of 365.41 g/mol. Its IUPAC name is N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide
PubChem CID46970583
Molecular FormulaC21H20FN3O2
Molecular Weight365.41 g/mol
Exact Mass365.15
IUPAC NameN-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(c1cc(-c2ccc(F)cc2)on1)N(Cc1ccccn1)C1CCCC1
InChIInChI=1S/C21H20FN3O2/c22-16-10-8-15(9-11-16)20-13-19(24-27-20)21(26)25(18-6-1-2-7-18)14-17-5-3-4-12-23-17/h3-5,8-13,18H,1-2,6-7,14H2
InChIKeyUEOTWRVTZKMQJQ-UHFFFAOYSA-N
XLogP4.46
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-N-[(4-fluorophenyl)methyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 39447049
N-cyclopentyl-N-[(5-methylthiophen-2-yl)methyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 70743438
(2S)-N-cyclohexyl-2-(dimethylamino)-2-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 97201502
N-cyclohexyl-1-methyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 74232119
N-(azepan-4-yl)-N-(pyridin-2-ylmethyl)-1,2,5-thiadiazole-3-carboxamide;hydrochloride
CID 129008074
N-cyclopropyl-1-(3-fluorophenyl)-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide
CID 47850677
5-amino-N-cyclopropyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 81317198
5-(4-fluorophenyl)-N-[[(2R)-oxolan-2-yl]methyl]-1,2-oxazole-3-carboxamide
CID 99599447
N-[(4S)-azepan-4-yl]-5-chloro-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 129474225
N-cyclohexyl-N-(pyridin-2-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide
CID 74234463
N-(azepan-4-yl)-N-(pyridin-2-ylmethyl)furan-3-carboxamide;hydrochloride
CID 129003740
2-cyclopentyl-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide
CID 16866847

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide (CID 46970583) is N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide is O=C(c1cc(-c2ccc(F)cc2)on1)N(Cc1ccccn1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is UEOTWRVTZKMQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN3O2/c22-16-10-8-15(9-11-16)20-13-19(24-27-20)21(26)25(18-6-1-2-7-18)14-17-5-3-4-12-23-17/h3-5,8-13,18H,1-2,6-7,14H2.
What are the key properties of N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide?
N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 365.41 g/mol, XLogP of 4.46, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 46970583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).