(2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide

C19H23FN2O — CID 125498890

IUPAC(2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide
SMILESCN[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H23FN2O/c1-19(2,3)14-7-11-16(12-8-14)22-18(23)17(21-4)13-5-9-15(20)10-6-13/h5-12,17,21H,1-4H3,(H,22,23)/t17-/m1/s1
InChIKeyJEKTUDCQQDDDAJ-QGZVFWFLSA-N
MW314.40 g/mol
LogP4.02
Rot. Bonds4

About (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide

(2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide (PubChem CID 125498890) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide.

Molecular Properties

Compound Name(2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide
PubChem CID125498890
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name(2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide
SMILESCN[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H23FN2O/c1-19(2,3)14-7-11-16(12-8-14)22-18(23)17(21-4)13-5-9-15(20)10-6-13/h5-12,17,21H,1-4H3,(H,22,23)/t17-/m1/s1
InChIKeyJEKTUDCQQDDDAJ-QGZVFWFLSA-N
XLogP4.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(4-tert-butylphenyl)-2-(6-methoxy-3-pyridinyl)-2-(methylamino)acetamide
CID 125498935
2-(4-tert-butylphenoxy)-N-(4-fluorophenyl)propanamide
CID 2938601
2-(methylamino)-2-phenyl-N-(4-propan-2-ylphenyl)acetamide;hydrochloride
CID 146675512
(2S)-N-(4-tert-butylphenyl)-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylpropanamide
CID 8779811
2-(4-fluoroanilino)-N-(4-fluorophenyl)-2-phenylacetamide
CID 46799428
(2S)-2-anilino-N-(4-fluorophenyl)-2-phenylacetamide
CID 7830464
N-(4-tert-butylphenyl)-2,2-diphenylacetamide
CID 7914210
2-(4-tert-butylphenoxy)-N-[4-[(4-fluorophenyl)sulfamoyl]phenyl]propanamide
CID 21367163
(R)-(4-tert-butylphenyl)-(4-fluorophenyl)methanol
CID 7146431
2-(4-fluorophenyl)-2-hydroxy-N-(4-methylphenyl)acetamide
CID 82132590
2-chloro-N-(4-fluorophenyl)propanamide
CID 532266
4-tert-butyl-N-[(1S)-1-(4-fluorophenyl)ethyl]benzamide
CID 95795806

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide?
The IUPAC name of (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide (CID 125498890) is (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide.
What is the SMILES notation for (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide?
The canonical SMILES for (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide is CN[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)c1ccc(F)cc1.
What is the InChIKey of (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide?
The InChIKey is JEKTUDCQQDDDAJ-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H23FN2O/c1-19(2,3)14-7-11-16(12-8-14)22-18(23)17(21-4)13-5-9-15(20)10-6-13/h5-12,17,21H,1-4H3,(H,22,23)/t17-/m1/s1.
What are the key properties of (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide?
(2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide has a molecular weight of 314.40 g/mol, XLogP of 4.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-tert-butylphenyl)-2-(4-fluorophenyl)-2-(methylamino)acetamide is sourced from PubChem (CID 125498890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).