(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide

C19H24FN3O2 — CID 95143206

IUPAC(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide
SMILESCc1noc(C)c1[C@@H](C)C(=O)Nc1cc(F)ccc1N1CCCCC1
InChIInChI=1S/C19H24FN3O2/c1-12(18-13(2)22-25-14(18)3)19(24)21-16-11-15(20)7-8-17(16)23-9-5-4-6-10-23/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,21,24)/t12-/m1/s1
InChIKeyVKEYEVQNYBGILO-GFCCVEGCSA-N
MW345.42 g/mol
LogP4.16
Rot. Bonds4

About (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide

(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide (PubChem CID 95143206) has the molecular formula C19H24FN3O2 and a molecular weight of 345.42 g/mol. Its IUPAC name is (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide
PubChem CID95143206
Molecular FormulaC19H24FN3O2
Molecular Weight345.42 g/mol
Exact Mass345.19
IUPAC Name(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide
SMILESCc1noc(C)c1[C@@H](C)C(=O)Nc1cc(F)ccc1N1CCCCC1
InChIInChI=1S/C19H24FN3O2/c1-12(18-13(2)22-25-14(18)3)19(24)21-16-11-15(20)7-8-17(16)23-9-5-4-6-10-23/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,21,24)/t12-/m1/s1
InChIKeyVKEYEVQNYBGILO-GFCCVEGCSA-N
XLogP4.16
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.42
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]amino]-4-fluorobenzoic acid
CID 97337342
3-(5-fluoro-2-piperidin-1-ylphenyl)-1-(2-hydroxypropyl)-1-propan-2-ylurea
CID 111969732
(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-methyl-4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]propanamide
CID 95139458
4-fluoro-N-(5-fluoro-2-pyrrolidin-1-ylphenyl)benzamide
CID 113092338
N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide
CID 113092590
N-(5-fluoro-2-piperidin-1-ylphenyl)oxane-4-carboxamide
CID 113092620
N-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclobutanecarboxamide
CID 113092391
2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide
CID 113092591
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(ethylaminomethyl)phenyl]propanamide
CID 75469343
(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-(4-fluorophenyl)-2-oxoazetidin-3-yl]propanamide
CID 97349438
3-fluoro-N-(5-fluoro-2-pyrrolidin-1-ylphenyl)benzamide
CID 113092337
(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluoro-2-nitrophenyl)butanamide
CID 95977922

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide?
The IUPAC name of (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide (CID 95143206) is (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide.
What is the SMILES notation for (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide?
The canonical SMILES for (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide is Cc1noc(C)c1[C@@H](C)C(=O)Nc1cc(F)ccc1N1CCCCC1.
What is the InChIKey of (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide?
The InChIKey is VKEYEVQNYBGILO-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H24FN3O2/c1-12(18-13(2)22-25-14(18)3)19(24)21-16-11-15(20)7-8-17(16)23-9-5-4-6-10-23/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,21,24)/t12-/m1/s1.
What are the key properties of (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide?
(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide has a molecular weight of 345.42 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-fluoro-2-piperidin-1-ylphenyl)propanamide is sourced from PubChem (CID 95143206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).